1,11-Undecanedicarboxylic acid supplier

Name
1,11-Undecanedicarboxylic acid
EINECS 208-011-4
CAS No. 505-52-2
Article Data64
CAS DataBase
Density 1.051 g/cm³
Solubility insoluble in water
Melting Point 112-114 °C(lit.)
Formula C₁₃H₂₄O₄
Boiling Point 422.5 °C at 760 mmHg
Molecular Weight 244.331
Flash Point 223.5 °C
Transport Information
Appearance white powder
Safety 26-37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 1,13-Tridecanedioic acid;NSC 9498;Brassylic acid;a,w-Tridecanedioic acid;
PSA 74.60000
LogP 3.44670

Synthetic route

: 112-86-7
cis-13-docosenoic acid

A: 112-05-0
nonanoic acid

B: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With oxygen; ozone In water; acetone at 0℃; Flow reactor;	A 74% B 88%

: 37167-18-3
2cyclododecanonecarboxylic acid N-phenylamide

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With sodium hydroxide; water In ethanol for 12h; Heating;	86%

: 63498-96-4
5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca<1,2-d>pyrimidine(1H,3H)-2,4-dione

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With potassium hydroxide at 250 - 300℃; for 7h;	67%

: 112-86-7
cis-13-docosenoic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With dihydrogen peroxide; ortho-tungstic acid In tert-butyl alcohol for 60h; Reflux;	53%
With sodium periodate; ruthenium trichloride In water; ethyl acetate; acetonitrile for 2h;	52%
With nitric acid

: 886-77-1
(E,E)-1,5-di-(2-furyl)pent-1,4-dien-3-one

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With hydrogenchloride Hydrierung der entstandenen 4.7.10-Trioxotridecandisaeure (als Natriumsalz) an einem Nickelkatalysator in Wasser bei 200grad und 130 at Druck;

: 506-33-2
Brassidic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With chloroform; ozone
With ozone; acetic acid

: 4549-33-1
1,9-Dibromononane

: 996-82-7
sodium diethylmalonate

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With ethanol at 125℃; Beim Verseifung und Erhitzen der Tetracarbonsaeure auf 180grad;
With ethanol Beim Verseifung und Erhitzen der Tetracarbonsaeure auf 180grad;

: 6006-37-7
tridecanedinitrile

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With potassium hydroxide
With hydrogenchloride at 120℃;

: 2834-05-1
11-bromoundecanoic acid

: 996-82-7
sodium diethylmalonate

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With ethanol Erwaermen des Reaktionsprodukts mit wss.Kalilauge und Erhitzen der erhaltenen Saeure auf 170grad;

: 6287-90-7
11-bromo-undecanoic acid methyl ester

: 996-82-7
sodium diethylmalonate

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
und Verseifen des entstehenden Undecantricarbonsaeureesters mit alkoholischer Kalilauge zur freie Saeure und Erhitzen diese auf ca.114grad;

: 2389-02-8
13-oxotetradecanoic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With sodium hypobromide

: 506-35-4
behenolic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With nitric acid

: 92155-72-1
7-oxotridecanoic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With sodium hydroxide; hydrazine hydrate; diethylene glycol at 195℃;

: 502-30-7
13-cyclopent-2-enyl-tridecanoic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With permanganate(VII) ion

: 54135-60-3
2,2'-methylenebis(cyclohexane-1,3-dione)

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With sodium hydroxide; hydrazine hydrate; diethylene glycol at 125℃; Reagens 4:Methanol; anschliessenden Erhitzen auf 195grad;

: 832-10-0
cyclotridecanone

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With chromium(VI) oxide; acetic acid

: 7735-38-8
13-hydroxytridecanoic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With nitric acid

: 24708-33-6
13-(2-furyl)-tridec-1-yne

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
(i) O3, EtOAc, AcOH, (ii) H2O, H2O2; Multistep reaction;

: 112-38-9
10-undecenoic acid

: 6279-86-3
methanetricarboxylic acid triethyl ester

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With di-tert-butyl peroxide

: 53227-26-2
undecane-1,1,11-tricarboxylic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
(i) aq. H2SO4, (ii) undecane, (heating); Multistep reaction;

: 22623-84-3
undecane-1,1,11-tricarboxylic acid-1,1-diethyl ester-11-methyl ester

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With potassium hydroxide In ethanol Heating;

: 4297-19-2
3,9-Dioxo-undecan-dicarbonsaeure-(1,11)

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With sodium hydroxide; hydrazine hydrate In diethylene glycol at 200 - 220℃;

: 14108-91-9
1,2-Cyclotetradecadien

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
(i) O3, (ii) AcOOH; Multistep reaction;

: 139662-49-0
1,5-Diazacyclooctadecan-6,18-dion

A: 505-52-2
brassylic acid

B: 10517-44-9
1,3-diaminopropane dihydrochloride

Conditions

Conditions	Yield
With hydrogenchloride In water at 150℃;

: 139662-50-3
1,6-Diazacyclononadecan-7,19-dion

A: 505-52-2
brassylic acid

B: 333-93-7
putrescine dihydrochloride

Conditions

Conditions	Yield
With hydrogenchloride In water at 150℃;

: 66819-72-5
2-oxo-cyclododecane-1-carbonitrile

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With hydrogenchloride; potassium hydroxide 1.) H2O, ethanol, reflux, 8 h; Yield given. Multistep reaction;

μ.ν-dioxy-behenic acid: μ.ν-dioxy-behenic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With potassium hydroxide; potassium chlorate at 200 - 220℃;

12-hydroxy-dodecane-carboxylic acid-(1): 12-hydroxy-dodecane-carboxylic acid-(1)

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With chromic acid; acetic acid

pelargonylbrassylamic acid: pelargonylbrassylamic acid

: 505-52-2
brassylic acid

Conditions

Conditions	Yield
With hydrogenchloride at 150℃;

: 105-38-4
vinyl propionate

: 505-52-2
brassylic acid

: 15423-11-7
divinyl tridecanedioate

Conditions

Conditions	Yield
With sulfuric acid; mercury(II) diacetate at 20 - 50℃; for 4h;	100%
With sulfuric acid; mercury(II) diacetate

: 617-86-7
triethylsilane

: 505-52-2
brassylic acid

: C37H84O4Si4

Conditions

Conditions	Yield
With decacarbonyldirhenium(0) In toluene at 20℃; for 9h; Concentration; Schlenk technique; Inert atmosphere; UV-irradiation;	99%
With dimanganese decacarbonyl In toluene at 20℃; for 3h; Inert atmosphere; Irradiation;	97%

: 505-52-2
brassylic acid

: 106-91-2
2,3-Epoxypropyl methacrylate

: bis[methacryloyloxy-2-hydroxy-propyl] tridecanedioate

Conditions

Conditions	Yield
With triphenylphosphine at 90℃; for 3h;	99%

: 67-56-1
methanol

: 505-52-2
brassylic acid

: 1472-87-3
dimethyl 1,11-undecanedicarboxylate

Conditions

Conditions	Yield
With sulfuric acid for 5h; Heating;	98%
With sulfuric acid for 2h; Reflux;	91%
With thionyl chloride	65%

: 505-52-2
brassylic acid

: 13362-52-2
1,13-tridecanediol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In tetrahydrofuran for 5.5h; Reflux;	97%
With zirconium(IV) borohydride In tetrahydrofuran at 25℃; for 1h; Reduction;	95%
With lithium aluminium tetrahydride In tetrahydrofuran for 2h; Ambient temperature;	93%

: 124-09-4
1,6-Hexanediamine

: 505-52-2
brassylic acid

: 54545-73-2
1,6-hexamethylene diamine brassylic acid

Conditions

Conditions	Yield
In ethanol at 50 - 80℃; for 2h;	96%

: 505-52-2
brassylic acid

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

: N1,N13-bis(3,4-dimethoxy-β-phenylethyl)brassyldiamide

Conditions

Conditions	Yield
In methanol at 178℃; for 2h;	91%

: 505-52-2
brassylic acid

: 35691-43-1
tridecanedioyl dichloride

Conditions

Conditions	Yield
With thionyl chloride In dichloromethane Heating;	90%
With thionyl chloride
With thionyl chloride for 3h; Heating;

: 505-52-2
brassylic acid

: 190579-30-7
3β-hydroxy-14β,16β-O-(4-methoxybenzylidene)card-20(22)-enolide

: 190579-39-6
hydrogen 14β,16β-O-(4-methoxybenzylidene)card-20(22)-enolide-3β-yl 1,11-undecanedicarboxylate

Conditions

Conditions	Yield
With pyridine; p-toluenesulfonyl chloride for 4h; Ambient temperature;	88%

: 505-52-2
brassylic acid

: 1309611-91-3
((3S,3aR,6S,6aR)-hexahydrofuro[3,2-b]furan-3,6-diyl)dimethanamine

: 1414371-76-8
isoidide-2,5-dimethylamine brassylic acid

Conditions

Conditions	Yield
In ethanol; water at 50 - 80℃; for 2h;	81%

: 505-52-2
brassylic acid

: 123820-43-9, 123820-44-0, 84393-12-4
[(1-methoxy-2-methyl-1-butenyl)oxy]trimethylsilane

: dimethyl 2,16-diethyl-2,16-dimethyl-3,15-dioxoheptadecanedioate

Conditions

Conditions	Yield
Stage #1: brassylic acid With 2,4-Dichlorobenzenesulfonyl chloride; triethylamine In dichloromethane at 0 - 5℃; for 1h; Stage #2: [(1-methoxy-2-methyl-1-butenyl)oxy]trimethylsilane With dmap; titanium tetrachloride In dichloromethane at 20 - 25℃; for 1.5h; Claisen condensation;	71%

: 505-52-2
brassylic acid

: C21H25N7O

: C55H70N14O4*6ClH

Conditions

Conditions	Yield
Stage #1: C21H25N7O With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide for 0.166667h; Cooling; Stage #2: brassylic acid In N,N-dimethyl-formamide for 0.166667h; Further stages;	70%

: 31469-15-5
1-methoxy-2-methyl-1-trimethylsiloxy-1-propene

: 505-52-2
brassylic acid

: dimethyl 2,2,16,16-tetramethyl-3,15-dioxoheptadecanedioate

Conditions

Conditions	Yield
Stage #1: brassylic acid With 2,4-Dichlorobenzenesulfonyl chloride; triethylamine In dichloromethane at 0 - 5℃; for 1h; Stage #2: 1-methoxy-2-methyl-1-trimethylsiloxy-1-propene With dmap; titanium tetrachloride In dichloromethane at 20 - 25℃; for 1.5h; Claisen condensation;	69%

: 505-52-2
brassylic acid

: 1484-85-1
3,4-methylenedioxyphenylethylamine

: N1,N13-bis(3,4-methylenedioxy-β-phenylethyl)brassyldiamide

Conditions

Conditions	Yield
In methanol at 178℃; for 2h;	69%

: 505-52-2
brassylic acid

: 1262389-74-1
C20-O-trityl-prostratin-ol

: C52H64O8

Conditions

Conditions	Yield
With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In dichloromethane at 20℃; for 19h;	57.84%

: 505-52-2
brassylic acid

: 566-28-9
7-Oxocholesterol

: 13-oxo-13-(7-ketocholest-5-en-3β-yloxy)tridecanoic acid

Conditions

Conditions	Yield
With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In acetone at 20℃; for 48h; Purification / work up;	56%

: 505-52-2
brassylic acid

: 100-39-0
benzyl bromide

A: 52175-11-8
Dibenzyl-brassylat

B: 261178-55-6
13-benzyloxy-13-oxotridecanoic acid

Conditions

Conditions	Yield
With potassium hydroxide; tetrabutylammomium bromide In tetrahydrofuran; methanol for 6h; Alkylation; Thermolysis;	A 22% B 52%

...Expand

: 366-18-7
[2,2]bipyridinyl

: uranyl nirate hexahydrate

: 505-52-2
brassylic acid

: C10H8N2*C13H22O4(2-)*O2U(2+)

Conditions

Conditions	Yield
With manganese (II) nitrate tetrahydrate In 1-methyl-pyrrolidin-2-one; water at 140℃; for 168h;	51%

...Expand

: 66-71-7
1,10-Phenanthroline

: uranyl nirate hexahydrate

: 505-52-2
brassylic acid

: C13H22O4(2-)*C12H8N2*O2U(2+)

Conditions

Conditions	Yield
With manganese (II) nitrate tetrahydrate In 1-methyl-pyrrolidin-2-one; water at 140℃;	47%

...Expand

: 505-52-2
brassylic acid

: 100-39-0
benzyl bromide

: 261178-55-6
13-benzyloxy-13-oxotridecanoic acid

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene In tetrahydrofuran; hexane; water; ethyl acetate at 0 - 20℃;	46%

: 505-52-2
brassylic acid

: 110224-49-2
template CS diol

: 110224-58-3
C64H68O4

Conditions

Conditions	Yield
With dmap; 4-(dimethylamino)pyridine hydrochloride; dicyclohexyl-carbodiimide In chloroform for 14h; Heating;	43%

: 505-52-2
brassylic acid

: 2-(4-(3-isopropyl-2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-indol-5-yl)piperidin-1-yl)ethan-1-amine

: N1,N13-bis(2-(4-(3-isopropyl-2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-indol-5-yl)piperidin-1-yl)ethyl)tridecanediamide

Conditions

Conditions	Yield
Stage #1: brassylic acid With N-ethyl-N,N-diisopropylamine; HATU In N,N-dimethyl-formamide for 0.5h; Stage #2: 2-(4-(3-isopropyl-2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-indol-5-yl)piperidin-1-yl)ethan-1-amine In N,N-dimethyl-formamide for 1h;	40.8%

: 505-52-2
brassylic acid

: 130-15-4
[1,4]naphthoquinone

: 132080-50-3
12-(1,4-Naphthochinon-2-yl)dodecansaeure

Conditions

Conditions	Yield
With ammonium peroxydisulfate; silver nitrate In water; acetonitrile for 0.166667h; Heating;	38%

: 14098-44-3
2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin

: 505-52-2
brassylic acid

: 135442-41-0
1,13-Bis-(6,7,9,10,12,13,15,16-octahydro-5,8,11,14,17-pentaoxa-benzocyclopentadecen-2-yl)-tridecane-1,13-dione

Conditions

Conditions	Yield
With PPA; Polyphosphoric acid (PPA) at 85 - 90℃; for 7h;	31%

: 505-52-2
brassylic acid

: 14691-88-4
4-amino-2,2,6,6-tetramethyl-1-piperidine-1-oxyl

: 82032-31-3
C22H41N2O4

Conditions

Conditions	Yield
With 4-dimethylpyridine; dicyclohexyl-carbodiimide In N,N-dimethyl-formamide 1.) 0 degC 45 min., 2.) R.T. 48 h;	26%

: 14098-24-9
2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin

: 505-52-2
brassylic acid

: 135442-44-3
1,13-Bis-(6,7,9,10,12,13,15,16,18,19-decahydro-5,8,11,14,17,20-hexaoxa-benzocyclooctadecen-2-yl)-tridecane-1,13-dione

Conditions

Conditions	Yield
With PPA; Polyphosphoric acid (PPA) at 85 - 90℃; for 7h;	22%

1,11-Undecanedicarboxylic acid Chemical Properties

IUPAC Name: Tridecanedioic acid
Systematic of Tridecanedioic acid (CAS NO.505-52-2): 11,13-Tridecanedioic acid ; AI3-18168 ; EINECS 208-011-4 ; NSC 9498
CAS NO: 505-52-2
Molecular Formula of Tridecanedioic acid (CAS NO.505-52-2): C₁₃H₂₄O₄
Molecular Weight: 244.3273
Molecular Structure:

Product Categories: Industrial/Fine Chemicals ; Miscellaneous Natural Products ; alpha,omega-Alkanedicarboxylic Acids ; alpha,omega-Bifunctional Alkanes ; Monofunctional & alpha,omega-Bifunctional Alkanes
Melting Point: 112-114 °C
Polar Surface Area: 52.6 Å²
Index of Refraction: 1.474
Molar Refractivity: 65.4 cm³
Molar Volume: 232.3 cm³
Surface Tension: 42.3 dyne/cm
Density of Tridecanedioic acid (CAS NO.505-52-2): 1.051 g/cm³
Flash Point: 223.5 °C
Enthalpy of Vaporization: 74.22 kJ/mol
Boiling Point: 422.5 °C at 760 mmHg
Vapour Pressure: 2.54E-08 mmHg at 25°C

1,11-Undecanedicarboxylic acid Uses

Brassylic acid(505-52-2) has been used in the production of high flavor, perfume and artificial musk-T, hot melt adhesives, and engineering plastics.
Brassylic acid(505-52-2) is also advanced food packaging materials and the main raw material for high-grade nylon 1313.

1,11-Undecanedicarboxylic acid Production

Cerived with Erucic acidl extracted by special rapeseed oi, by a further decomposition after ozone's oxidation.
In addition, straight-chain alkanes with the raw materials, but also can be from the synthetic of the straight-chain olefins, saturated or unsaturated fatty acids, 16 (alkyl) ester.

1,11-Undecanedicarboxylic acid Safety Profile

Hazard Codes: Irritant Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39: Wear suitable gloves and eye/face protection.
WGK Germany: 3
HS Code: 29171990

Product Name

1,11-Undecanedicarboxylic acid

Synthetic route

1,11-Undecanedicarboxylic acid Chemical Properties

1,11-Undecanedicarboxylic acid Uses

1,11-Undecanedicarboxylic acid Production

1,11-Undecanedicarboxylic acid Safety Profile

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