Product Name

  • Name

    Menatetrenone

  • EINECS
  • CAS No. 863-61-6
  • Article Data11
  • CAS DataBase
  • Density 0.994 g/cm3
  • Solubility
  • Melting Point 350 °C
  • Formula C31H40O2
  • Boiling Point 570.6 °C at 760 mmHg
  • Molecular Weight 444.657
  • Flash Point 208.3 °C
  • Transport Information
  • Appearance yellow crystals
  • Safety 22-24/25
  • Risk Codes
  • Molecular Structure Molecular Structure of 863-61-6 (Menatetrenone)
  • Hazard Symbols
  • Synonyms Vitamin K2(mk-4);1,4-Naphthalenedione,2-methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, (E,E,E)-;1,4-Naphthalenedione,2-methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-(9CI);2-Methyl-3-geranylgeranyl-1,4-naphthoquinone;Glakay;Kaytwo;MK4;Menaquinone4;Menaquinone K4;Vitamin K2(20);Vitamin MK 4;
  • PSA 34.14000
  • LogP 8.91790

Synthetic route

(2'E,6'E,10'E,14'E)-2-(3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl)-1,4-dimethoxy-3-methylnaphthalene
66958-54-1

(2'E,6'E,10'E,14'E)-2-(3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl)-1,4-dimethoxy-3-methylnaphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With ammonium cerium (IV) nitrate In water; acetonitrile at 10 - 20℃; for 1h;90.6%
With ammonium cerium(IV) nitrate; triisooctyl amine In hexane; water; acetonitrile for 0.5h;86%
With ammonium cerium(IV) nitrate In dichloromethane; acetonitrile at 0℃; for 0.5h;72%
2-<9'-(2-pyridylthio)-tetraprenyl>-3-methyl-1,4-dimethoxynaphthalene
94827-99-3

2-<9'-(2-pyridylthio)-tetraprenyl>-3-methyl-1,4-dimethoxynaphthalene

A

menatetrenone
863-61-6

menatetrenone

B

2-Methyl-3-((2E,6E,9E)-3,7,11,15-tetramethyl-hexadeca-2,6,9,14-tetraenyl)-2,3-dihydro-[1,4]naphthoquinone

2-Methyl-3-((2E,6E,9E)-3,7,11,15-tetramethyl-hexadeca-2,6,9,14-tetraenyl)-2,3-dihydro-[1,4]naphthoquinone

Conditions
ConditionsYield
With lithium aluminium tetrahydride; ammonium cerium(IV) nitrate; lithium methanolate; copper dichloride 1.) THF, 1 h, reflux; 2.) CH2Cl2, CH3CN, H2O, 0 deg C; Yield given. Multistep reaction. Yields of byproduct given;
2-(5'-p-tosyl-tetraprenyl)-3-methyl-1,4-dibenzyloxynaphthalene
94828-03-2

2-(5'-p-tosyl-tetraprenyl)-3-methyl-1,4-dibenzyloxynaphthalene

A

menatetrenone
863-61-6

menatetrenone

B

2-Methyl-3-((2E,5E,10E)-3,7,11,15-tetramethyl-hexadeca-2,5,10,14-tetraenyl)-[1,4]naphthoquinone

2-Methyl-3-((2E,5E,10E)-3,7,11,15-tetramethyl-hexadeca-2,5,10,14-tetraenyl)-[1,4]naphthoquinone

Conditions
ConditionsYield
With oxygen; lithium; ethylamine 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O; Yield given. Multistep reaction;
2-(9'-p-tosyl-tetraprenyl)-3-methyl-1,4-dibenzyloxynaphthalene
94828-02-1

2-(9'-p-tosyl-tetraprenyl)-3-methyl-1,4-dibenzyloxynaphthalene

A

menatetrenone
863-61-6

menatetrenone

B

2-Methyl-3-((2E,6E,9E)-3,7,11,15-tetramethyl-hexadeca-2,6,9,14-tetraenyl)-2,3-dihydro-[1,4]naphthoquinone

2-Methyl-3-((2E,6E,9E)-3,7,11,15-tetramethyl-hexadeca-2,6,9,14-tetraenyl)-2,3-dihydro-[1,4]naphthoquinone

Conditions
ConditionsYield
With oxygen; lithium; ethylamine 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O; Yield given. Multistep reaction;
4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-04-8

4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With isotonic phosphate buffer; rat liver homogenate at 37℃; pH=7.4; Kinetics; Further Variations:; Reagents; Hydrolysis;
1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-03-7

1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With isotonic phosphate buffer; rat liver homogenate at 37℃; pH=7.4; Kinetics; Further Variations:; Reagents; Hydrolysis;
1,4-bis(N,N-dimethylglycyloxy)-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-05-9

1,4-bis(N,N-dimethylglycyloxy)-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

A

menatetrenone
863-61-6

menatetrenone

B

4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-04-8

4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

C

1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-03-7

1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

Conditions
ConditionsYield
With isotonic phosphate buffer; rat liver homogenate at 37℃; pH=7.4; Kinetics; Further Variations:; Reagents; Hydrolysis;
...Expand
1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene hydrocloride

1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene hydrocloride

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With male Wistar rat liver microsome preparation In water at 25℃; Enzyme kinetics; Hydrolysis; Enzymatic reaction;
4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene hydrochloride

4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene hydrochloride

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With male Wistar rat liver microsome preparation In water at 25℃; Enzyme kinetics; Hydrolysis; Enzymatic reaction;
1,4-bis(N,N-dimethylglycyloxy)-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene dihydrochloride

1,4-bis(N,N-dimethylglycyloxy)-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene dihydrochloride

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With male Wistar rat liver microsome preparation In water at 25℃; Enzyme kinetics; Hydrolysis; Enzymatic reaction;
2-methyl-1,4-naphthohydroquinone
481-85-6

2-methyl-1,4-naphthohydroquinone

3,7,11,15-tetramethyl-hexadec-1,6t,10t,14-tetraen-3-ol

3,7,11,15-tetramethyl-hexadec-1,6t,10t,14-tetraen-3-ol

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With boron trifluoride diethyl etherate; zinc(II) chloride anschliessendes Behandeln mit Ag2O;
farnesyl bromide
24163-93-7, 24163-94-8, 56881-57-3, 6874-67-5, 28290-41-7

farnesyl bromide

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 95 percent / t-BuOK / tetrahydrofuran / 5 h / -20 °C
2: 95 percent / Pd(dppe)Cl2; LiEt3BH / tetrahydrofuran / 1 h / 0 °C
3: 72 percent / aq. CAN / CH2Cl2; acetonitrile / 0.5 h / 0 °C
View Scheme
(2′E)-2-(3′-methyl-4′-phenylsulfonylbut-2′-enyl)-1,4-dimethoxy-3-methylnaphthalene
73875-18-0

(2′E)-2-(3′-methyl-4′-phenylsulfonylbut-2′-enyl)-1,4-dimethoxy-3-methylnaphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 95 percent / t-BuOK / tetrahydrofuran / 5 h / -20 °C
2: 95 percent / Pd(dppe)Cl2; LiEt3BH / tetrahydrofuran / 1 h / 0 °C
3: 72 percent / aq. CAN / CH2Cl2; acetonitrile / 0.5 h / 0 °C
View Scheme
(2'E,6'E,10'E,14'E)-2-(4'-phenylsulfonyl-3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl)-1,4-dimethoxy-3-methylnaphthalene
618457-08-2

(2'E,6'E,10'E,14'E)-2-(4'-phenylsulfonyl-3',7',11',15'-tetramethylhexadeca-2',6',10',14'-tetraenyl)-1,4-dimethoxy-3-methylnaphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 95 percent / Pd(dppe)Cl2; LiEt3BH / tetrahydrofuran / 1 h / 0 °C
2: 72 percent / aq. CAN / CH2Cl2; acetonitrile / 0.5 h / 0 °C
View Scheme
2-bromo-3-methyl-1,4-dimethoxynaphthalene
53772-33-1

2-bromo-3-methyl-1,4-dimethoxynaphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 58 percent / n-BuLi / diethyl ether / 1.) 0 deg , 10 min; 1 h, 2.) 0 deg C, 30 min
2: 2.) THF, 0-5 deg C, 10 min, sonication
3: 86 percent / cerium ammonium nitrate, Adogen / acetonitrile; H2O; hexane / 0.5 h
View Scheme
Multi-step reaction with 3 steps
1.1: n-butyllithium / tetrahydrofuran; hexane / 1 h / -78 °C / Inert atmosphere
1.2: 0.5 h / -78 °C / Inert atmosphere
2.1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride / N,N-dimethyl-formamide / 15 h / 70 °C
3.1: ammonium cerium (IV) nitrate / acetonitrile; water / 1 h / 10 - 20 °C
View Scheme
Multi-step reaction with 3 steps
1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride / 1,4-dioxane / 10 h / 100 °C
2: potassium acetate; tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl-formamide / 15 h / 100 °C
3: ammonium cerium (IV) nitrate / acetonitrile; water / 1 h / 10 - 20 °C
View Scheme
(2Ξ,6E,10E)-3,7,11,15-tetramethyl-hexadeca-2,6,10,14-tetraenal
132513-59-8

(2Ξ,6E,10E)-3,7,11,15-tetramethyl-hexadeca-2,6,10,14-tetraenal

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 58 percent / n-BuLi / diethyl ether / 1.) 0 deg , 10 min; 1 h, 2.) 0 deg C, 30 min
2: 2.) THF, 0-5 deg C, 10 min, sonication
3: 86 percent / cerium ammonium nitrate, Adogen / acetonitrile; H2O; hexane / 0.5 h
View Scheme
(2'E,6'E,10'E)-2-Methyl-3-(1'-hydroxy-3',7',11',15'-tetramethyl-2',6',10',14'-hexadecatetraenyl)-1,4-dimethoxynaphthalene
156840-09-4

(2'E,6'E,10'E)-2-Methyl-3-(1'-hydroxy-3',7',11',15'-tetramethyl-2',6',10',14'-hexadecatetraenyl)-1,4-dimethoxynaphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 2.) THF, 0-5 deg C, 10 min, sonication
2: 86 percent / cerium ammonium nitrate, Adogen / acetonitrile; H2O; hexane / 0.5 h
View Scheme
trans-geranyl bromide
6138-90-5

trans-geranyl bromide

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 85 percent / dimethylformamide / 16 h / Ambient temperature
2: 75 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
3: 1.) CuCl2, LiAlH4, MeOLi; 2.) ceric ammonium nitrate / 1.) THF, 1 h, reflux; 2.) CH2Cl2, CH3CN, H2O, 0 deg C
View Scheme
3,7-dimethyl-1-(p-toluenesulfonyl)-2(E),6-octadiene
53254-60-7

3,7-dimethyl-1-(p-toluenesulfonyl)-2(E),6-octadiene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 86 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
2: 1.) Li in EtNH2; 2.) oxygen / 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O
View Scheme
(2E,6E)-3,7,11-trimethyl-1-(p-tolylsulfonyl)dodeca-2,6,10-triene
68690-45-9, 80370-68-9, 53254-63-0

(2E,6E)-3,7,11-trimethyl-1-(p-tolylsulfonyl)dodeca-2,6,10-triene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 87 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
2: 1.) Li in EtNH2; 2.) oxygen / 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O
View Scheme
2-[(2E)-3,7-dimethyl-2,6-octadienyl]sulfanylpyridine
82895-40-7

2-[(2E)-3,7-dimethyl-2,6-octadienyl]sulfanylpyridine

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 75 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
2: 1.) CuCl2, LiAlH4, MeOLi; 2.) ceric ammonium nitrate / 1.) THF, 1 h, reflux; 2.) CH2Cl2, CH3CN, H2O, 0 deg C
View Scheme
2-(8-bromo-3,7-dimethyl-octa-2,6-dienyl)-1,4-dimethoxy-3-methyl-naphtalene
94828-13-4

2-(8-bromo-3,7-dimethyl-octa-2,6-dienyl)-1,4-dimethoxy-3-methyl-naphtalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 75 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
2: 1.) CuCl2, LiAlH4, MeOLi; 2.) ceric ammonium nitrate / 1.) THF, 1 h, reflux; 2.) CH2Cl2, CH3CN, H2O, 0 deg C
View Scheme
8-(1,4-dimethoxy-3-methyl-naphtalen-2-yl)-2,6-dimethyl-octa-2,6-dien-1-ol
94828-05-4

8-(1,4-dimethoxy-3-methyl-naphtalen-2-yl)-2,6-dimethyl-octa-2,6-dien-1-ol

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: PBr3 / diethyl ether / 1.5 h / 0 °C
2: 75 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
3: 1.) CuCl2, LiAlH4, MeOLi; 2.) ceric ammonium nitrate / 1.) THF, 1 h, reflux; 2.) CH2Cl2, CH3CN, H2O, 0 deg C
View Scheme
(E)-4-(1,4-Bis-benzyloxy-3-methyl-naphthalen-2-yl)-2-methyl-but-2-en-1-ol
94828-30-5

(E)-4-(1,4-Bis-benzyloxy-3-methyl-naphthalen-2-yl)-2-methyl-but-2-en-1-ol

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: PBr3 / diethyl ether / 1.5 h / 0 °C
2: 87 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
3: 1.) Li in EtNH2; 2.) oxygen / 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O
View Scheme
1,4-Bis-benzyloxy-2-((E)-4-bromo-3-methyl-but-2-enyl)-3-methyl-naphthalene
94828-04-3

1,4-Bis-benzyloxy-2-((E)-4-bromo-3-methyl-but-2-enyl)-3-methyl-naphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 87 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
2: 1.) Li in EtNH2; 2.) oxygen / 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O
View Scheme
(2E,6E)-8-(1,4-Bis-benzyloxy-3-methyl-naphthalen-2-yl)-2,6-dimethyl-octa-2,6-dien-1-ol
94828-06-5

(2E,6E)-8-(1,4-Bis-benzyloxy-3-methyl-naphthalen-2-yl)-2,6-dimethyl-octa-2,6-dien-1-ol

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: PBr3 / diethyl ether / 1.5 h / 0 °C
2: 86 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
3: 1.) Li in EtNH2; 2.) oxygen / 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O
View Scheme
1,4-Bis-benzyloxy-2-((2E,6E)-8-bromo-3,7-dimethyl-octa-2,6-dienyl)-3-methyl-naphthalene
94828-14-5

1,4-Bis-benzyloxy-2-((2E,6E)-8-bromo-3,7-dimethyl-octa-2,6-dienyl)-3-methyl-naphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 86 percent / 1.) hexamethylphosphoric triamide, BuLi / tetrahydrofuran; hexane / -70 - 0 °C
2: 1.) Li in EtNH2; 2.) oxygen / 1.) THF, -70 deg C; 2.) THF, MeOH, H2O, Et2O
View Scheme
menahydroquinone-4
39776-45-9

menahydroquinone-4

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
With oxygen; sodium chloride In hexane; water; ethyl acetate; toluene at 25 - 40℃; for 3h; Product distribution / selectivity;
With oxygen In water; toluene at 30 - 60℃; for 15h; Product distribution / selectivity;
1,4-dimethoxy-2-methylnaphthalene
53772-19-3

1,4-dimethoxy-2-methylnaphthalene

menatetrenone
863-61-6

menatetrenone

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1.1: bromine / dichloromethane / 2 h / 10 °C
2.1: n-butyllithium / tetrahydrofuran; hexane / 1 h / -78 °C / Inert atmosphere
2.2: 0.5 h / -78 °C / Inert atmosphere
3.1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride / N,N-dimethyl-formamide / 15 h / 70 °C
4.1: ammonium cerium (IV) nitrate / acetonitrile; water / 1 h / 10 - 20 °C
View Scheme
Multi-step reaction with 4 steps
1: bromine / dichloromethane / 2 h / 10 °C
2: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride / 1,4-dioxane / 10 h / 100 °C
3: potassium acetate; tetrakis(triphenylphosphine) palladium(0) / N,N-dimethyl-formamide / 15 h / 100 °C
4: ammonium cerium (IV) nitrate / acetonitrile; water / 1 h / 10 - 20 °C
View Scheme
menatetrenone
863-61-6

menatetrenone

menahydroquinone-4
39776-45-9

menahydroquinone-4

Conditions
ConditionsYield
With sodium tetrahydroborate In methanol; di-isopropyl ether for 0.166667h; Reduction;
menatetrenone
863-61-6

menatetrenone

C31H40O2

C31H40O2

Conditions
ConditionsYield
In acetonitrile at 20 - 22℃; Flash photolysis;
menatetrenone
863-61-6

menatetrenone

4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-04-8

4-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: NaBH4 / diisopropyl ether; methanol / 0.17 h
2: dicyclohexylcarbodiimide; pyridine / 24 h / 20 °C
View Scheme
menatetrenone
863-61-6

menatetrenone

1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-03-7

1-N,N-dimethylglycyloxy-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: NaBH4 / diisopropyl ether; methanol / 0.17 h
2: dicyclohexylcarbodiimide; pyridine / 24 h / 20 °C
View Scheme
menatetrenone
863-61-6

menatetrenone

1,4-bis(N,N-dimethylglycyloxy)-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene
197071-05-9

1,4-bis(N,N-dimethylglycyloxy)-2-methyl-3-tetraprenyl-4-hydroxy-naphthalene

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: NaBH4 / diisopropyl ether; methanol / 0.17 h
2: dicyclohexylcarbodiimide; pyridine / 24 h / 20 °C
View Scheme

Menatetrenone Chemical Properties

The molecular structure of Menatetrenone (CAS NO.863-61-6):

IUPAC Name: 2-Methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]naphthalene-1,4-dione 
Molecular Weight: 444.6481 g/mol
Molecular Formula: C31H40O2
Density: 0.994 g/cm3 
Melting Point: 350 °C
Boiling Point: 570.6 °C at 760 mmHg 
Flash Point: 208.3 °C
Index of Refraction: 1.538
Molar Refractivity: 139.92 cm3
Molar Volume: 446.8 cm3
Surface Tension: 36.7 dyne/cm 
Enthalpy of Vaporization: 85.57 kJ/mol
Vapour Pressure: 4.97E-13 mmHg at 25 °C 
Storage Temp.: −20 °C
XLogP3: 8.9
H-Bond Acceptor: 2
Rotatable Bond Count: 11
Tautomer Count: 27
Exact Mass: 444.302831
MonoIsotopic Mass: 444.302831
Topological Polar Surface Area: 34.1
Heavy Atom Count: 33
Canonical SMILES: CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C
Isomeric SMILES: CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C
InChI: InChI=1S/C31H40O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,12,14,16,18-20H,9-11,13,15,17,21H2,1-6H3/b23-14+,24-16+,25-20+
InChIKey: DKHGMERMDICWDU-GHDNBGIDSA-N
Product Categories: Vitamins and derivatives; Osteoporosis; Intermediates & Fine Chemicals; Pharmaceuticals

Menatetrenone Uses

 Menatetrenone (CAS NO.863-61-6) is used as Vitamin (prothrombogenic). It is also used as a hemostatic agent and as adjunctive therapy for the pain of osteoporosis.

Menatetrenone Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD oral > 1gm/kg (1000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.
dog LD unreported > 3gm/kg (3000mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 37, Pg. 2518, 1995.
dog LD50 intravenous > 40mL/kg (40mL/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BLOOD: PIGMENTED OR NUCLEATED RED BLLOD CELLS		 Kiso to Rinsho. Clinical Report. Vol. 25, Pg. 2003, 1991.
monkey LD50 intravenous > 10mL/kg (10mL/kg) BLOOD: CHANGES IN CELL COUNT (UNSPECIFIED) Kiso to Rinsho. Clinical Report. Vol. 25, Pg. 2003, 1991.
mouse LD oral > 5mg/kg (5mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.
mouse LD50 intravenous > 40mL/kg (40mL/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER Kiso to Rinsho. Clinical Report. Vol. 25, Pg. 2003, 1991.
mouse LDLo intraperitoneal 5gm/kg (5000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.
mouse LDLo subcutaneous 5gm/kg (5000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.
rabbit LD intravenous > 100mg/kg (100mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 461, 1971.
rabbit LDLo subcutaneous 100mg/kg (100mg/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, OTHER: AFTER SYSTEMIC EXPOSURE" Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 461, 1971.
rat LD oral > 5gm/kg (5000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.
rat LD subcutaneous > 5gm/kg (5000mg/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, OTHER: AFTER SYSTEMIC EXPOSURE" Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.
rat LD50 intravenous > 40mL/kg (40mL/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER Kiso to Rinsho. Clinical Report. Vol. 25, Pg. 2003, 1991.
rat LDLo intraperitoneal 5gm/kg (5000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 5, Pg. 445, 1971.

Menatetrenone Safety Profile

Safety Statements: 22-24/25 
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
RTECS: QL9279500
An experimental teratogen. Experimental reproductive effects. When heated to decomposition it emits acrid smoke and irritating fumes.

Menatetrenone Specification

 Menatetrenone (CAS NO.863-61-6) is also named as 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthochinon ; 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthoquinone ; 2-Methyl-3-geranylgeranyl-1,4-naphthoquinone ; 2-Methyl-3-trans-tetraprenyl-1,4-naphthoquinone ; E3100 ; K2(sub 20) ; Kaytwo ; Kephton ; MK4 ; Menaquinone K4 ; Menaquinone-4 ; Menatetrenona ; Menatetrenona [INN-Spanish] ; Menatetrenonum ; Menatetrenonum [INN-Latin] ; UNII-27Y876D139 ; Vitamin K2(sub 20) ; Vitamin MK 4 . Menatetrenone (CAS NO.863-61-6) is yellow crystals.

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