trans-4-Methylcyclohexyl amine supplier

Name
trans-4-Methylcyclohexyl amine
EINECS 228-673-8
CAS No. 2523-55-9
Article Data26
CAS DataBase
Density 0.845 g/cm³
Solubility
Melting Point -8.5°C (estimate)
Formula C₇H₁₅N
Boiling Point 149.324 °C at 760 mmHg
Molecular Weight 113.203
Flash Point 26.667 °C
Transport Information
Appearance
Safety 16-28
Risk Codes 10-35
Molecular Structure
Hazard Symbols C
Synonyms Cyclohexylamine,4-methyl-, trans- (8CI);4-trans-Methylcyclohexylamine;trans-1-Amino-4-methylcyclohexane;trans-4-Methyl-1-cyclohexanamine;
PSA 26.02000
LogP 2.22410

Synthetic route

: 106-49-0
p-toluidine

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 2523-56-0
cis-4-methylcyclohexanamine

C: 84518-71-8, 109667-09-6
4,4'-dimethyldicyclohexylamine

Conditions

Conditions	Yield
With hydrogen In tetrahydrofuran at 110℃; under 75007.5 Torr; for 3h; Kinetics; Reagent/catalyst; Temperature; Autoclave;	A 63.6% B 30.2% C n/a

...Expand

: 589-91-3
p-methylcyclohexanol

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 84518-71-8, 109667-09-6
4,4'-dimethyldicyclohexylamine

Conditions

Conditions	Yield
With ammonia; thorium dioxide at 290 - 320℃;

: 4994-13-2, 128925-57-5, 128925-58-6
4-methylcyclohexanone oxime

: 2523-55-9
trans-4-methylcyclohexanamine

Conditions

Conditions	Yield
With hydrogen; nickel at 280℃;
With lithium aluminium tetrahydride
With sodium In ethanol
With ethanol; sodium Heating;
With ethanol; sodium

: 106-49-0
p-toluidine

: 2523-55-9
trans-4-methylcyclohexanamine

Conditions

Conditions	Yield
With lithium
With hydrogen; silica gel; rhodium In 2,2,4-trimethylpentane at 49.85℃; Activation energy; Further Variations:; Catalysts;

: 106-49-0
p-toluidine

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 2523-56-0
cis-4-methylcyclohexanamine

Conditions

Conditions	Yield
With hydrogenchloride; hydrogen; acetic acid; platinum at 25℃; under 2280 Torr;
With hydrogen; silica gel; rhodium In 2,2,4-trimethylpentane at 49.85℃; Product distribution; Further Variations:; Catalysts;
With hydrogen In 1,4-dioxane at 100℃; under 15001.5 Torr; for 3.33333h; Autoclave;	A n/a B n/a

: 77287-34-4, 77287-35-5, 60100-09-6
formamide

: 589-92-4
1-methylcyclohexan-4-one

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 2523-56-0
cis-4-methylcyclohexanamine

Conditions

Conditions	Yield
With formic acid anschliessendes Erhitzen mit wss.HCl;

...Expand

: 103-89-9
4-Methylacetanilide

: 2523-55-9
trans-4-methylcyclohexanamine

Conditions

Conditions	Yield
With ethanol; platinum at 70 - 80℃; under 2280 Torr; Hydrogenation.anschliessend man verseift durch Erhitzen mit konz. Salzsaere auf 130-140grad;

: 589-92-4
1-methylcyclohexan-4-one

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 2523-56-0
cis-4-methylcyclohexanamine

Conditions

Conditions	Yield
Yield given. Multistep reaction. Yields of byproduct given;
With decane; (S)-1-phenyl-ethylamine; Chromobacterium violaceum amine transaminase A W60 C In tert-butyl methyl ether at 37℃; pH=8.2; Enzymatic reaction; stereoselective reaction;	A n/a B n/a
With decane; (S)-1-phenyl-ethylamine; Vibrio fluvialis amine transaminase A In tert-butyl methyl ether at 37℃; pH=8.2; Catalytic behavior; Reagent/catalyst; Solvent; Enzymatic reaction; stereoselective reaction;	A n/a B n/a

: 106-49-0
p-toluidine

: 75-04-7
ethylamine

lithium: lithium

: 2523-55-9
trans-4-methylcyclohexanamine

...Expand

1-methyl-cyclohexanone-(4)-oxime: 1-methyl-cyclohexanone-(4)-oxime

: 2523-55-9
trans-4-methylcyclohexanamine

Conditions

Conditions	Yield
With ethanol; sodium

: 64-17-5
ethanol

: 4994-13-2, 128925-57-5, 128925-58-6
4-methylcyclohexanone oxime

sodium: sodium

: 2523-55-9
trans-4-methylcyclohexanamine

...Expand

: 99-99-0
1-methyl-4-nitrobenzene

: 75-04-7
ethylamine

lithium: lithium

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 106-49-0
p-toluidine

...Expand

: 99-99-0
1-methyl-4-nitrobenzene

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 2523-56-0
cis-4-methylcyclohexanamine

Conditions

Conditions	Yield
With hydrogen In tetrahydrofuran at 110℃; under 75007.5 Torr; for 3h; Kinetics; Autoclave; diastereoselective reaction;	A n/a B n/a

: 106-44-5
p-cresol

A: 2523-55-9
trans-4-methylcyclohexanamine

B: 2523-56-0
cis-4-methylcyclohexanamine

Conditions

Conditions	Yield
With methanol; 5% Rh/C; ammonia; hydrogen; isopropyl alcohol In Hexadecane at 140℃; under 12001.2 Torr; for 16h; Autoclave;	A n/a B n/a
With alumina-supported nickel; ammonia; hydrogen In toluene at 160℃; for 6h; Time; High pressure; Overall yield = 96 percentChromat.;	A n/a B n/a

: 589-92-4
1-methylcyclohexan-4-one

: 2523-55-9
trans-4-methylcyclohexanamine

Conditions

Conditions	Yield
With decane; (S)-1-phenyl-ethylamine; Chromobacterium violaceum amine transaminase A W60 C In tert-butyl methyl ether at 37℃; pH=8.2; Enzymatic reaction; stereoselective reaction;	n/a

: C19H25N3O6S

: 2523-55-9
trans-4-methylcyclohexanamine

: 93479-97-1
glimepiride

Conditions

Conditions	Yield
dmap In toluene Heating / reflux;	95%
With dmap In toluene Heating / reflux;	95%

: 2523-55-9
trans-4-methylcyclohexanamine

: 98-74-8
4-Nitrobenzenesulfonyl chloride

: N-(4-methylcyclohexyl)-4-nitrobenzenesulfonamide

Conditions

Conditions	Yield
With pyridine In dichloromethane at 20℃; Inert atmosphere;	87.7%

: 2523-55-9
trans-4-methylcyclohexanamine

: 65-85-0
benzoic acid

: 32175-04-5
trans-4-benzamino-1-methyl-cyclohexane

Conditions

Conditions	Yield
Stage #1: benzoic acid With N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In dichloromethane at 0℃; for 0.166667h; Stage #2: trans-4-methylcyclohexanamine With N-ethyl-N,N-diisopropylamine In dichloromethane at 0 - 20℃; for 5h;	85%

: 2523-55-9
trans-4-methylcyclohexanamine

: 4023-02-3
1H-pyrazole-1-carboximidamide hydrochloride

: 1383718-92-0
1-trans-(4-methylcyclohexyl)guanidinium chloride

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 60℃; for 15h;	84%

: 102-09-0
bis(phenyl) carbonate

: 2523-55-9
trans-4-methylcyclohexanamine

: phenyl ((1r,4r)-4-methylcyclohexyl)carbamate

Conditions

Conditions	Yield
In tetrahydrofuran; water at 20℃; for 8h;	84%
In tetrahydrofuran; water at 20℃; for 8h;	84%

: 2523-55-9
trans-4-methylcyclohexanamine

: 3282-30-2
pivaloyl chloride

: C12H23NO

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 0 - 20℃; Inert atmosphere;	83%

: 701-45-1
2-bromo-1-fluoro-4-nitrobenzene

: 2523-55-9
trans-4-methylcyclohexanamine

: 2-bromo-N-((1r,4r)-4-methylcyclohexyl)-4-nitroaniline

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In 1-methyl-pyrrolidin-2-one at 130℃; for 18h;	79%

: 2523-55-9
trans-4-methylcyclohexanamine

: 175357-98-9
4-chloro-6-fluoro-pyrido[3,4-d]pyrimidine

: 845522-46-5
(6-Fluoro-pyrido[3,4-d]pyrimidin-4-yl)-(trans-4-methyl-cyclohexyl)-amine

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; for 18h;	78%

: 85-44-9
phthalic anhydride

: 2523-55-9
trans-4-methylcyclohexanamine

: 31916-39-9
Trans-1-Methyl-4-phthalimidocyclohexan

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 150℃;	78%

: 2523-55-9
trans-4-methylcyclohexanamine

: (3-bromo-4-fluorophenyl)(1-chlorocyclopropyl)(imino)-λ6-sulfanone

: (3-bromo-4-((trans-4-methylcyclohexyl)amino)phenyl)(1-chlorocyclopropyl)(imino)-λ6-sulfanone

Conditions

Conditions	Yield
at 80℃; for 6h; Inert atmosphere;	77%

: 2523-55-9
trans-4-methylcyclohexanamine

: C9H4Cl2N4

: C16H18ClN5

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 16h;	76%

: 2523-55-9
trans-4-methylcyclohexanamine

: (3-bromo-4-fluorophenyl)(cyclopropyl)(imino)-λ6-sulfanone

: (3-bromo-4-((trans-4-methylcyclohexyl)amino)phenyl) (cyclopropyl)(imino)-λ6-sulfanone

Conditions

Conditions	Yield
at 90℃; for 5h; Temperature; Inert atmosphere;	75%

: 2523-55-9
trans-4-methylcyclohexanamine

: 4-(2,6-dimethoxybenzamido)-1H-pyrazole-3-carboxylic acid

: (4-(2,6-dimethoxybenzamido)-N-(4-methylcyclohexyl)-1H-pyrazole-3-carboxamide)

Conditions

Conditions	Yield
With benzotriazol-1-ol In acetonitrile at 100℃; for 0.166667h; Microwave irradiation; Inert atmosphere;	74%

: 101861-63-6
4,6-dichloro-1H-indole-2-carboxylic acid

: 2523-55-9
trans-4-methylcyclohexanamine

: 1473450-32-6
4,6-dichloro-N-(trans-4-methylcyclohexyl)-1H-indole-2-carboxamide

Conditions

Conditions	Yield
Stage #1: 4,6-dichloro-1H-indole-2-carboxylic acid With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In N,N-dimethyl-formamide at 20℃; for 0.166667h; Stage #2: trans-4-methylcyclohexanamine In N,N-dimethyl-formamide at 20℃; for 16h;	66%

: 2523-55-9
trans-4-methylcyclohexanamine

: ethyl 4,4-dimethyl-2-(5-methyl-2-oxo-4-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)-6-(p-tolyl)pyridin-1(2H)-yl)pentanoate

: ethyl 4,4-dimethyl-2-(5-methyl-4-(5-(((1r,4r)-4-methylcyclohexyl)amino)-1,3,4-oxadiazol-2-yl)-2-oxo-6-(p-tolyl)pyridin-1(2H)-yl)pentanoate

Conditions

Conditions	Yield
With (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 12h;	66%

: 174581-51-2
acetic acid 2-isocyanoethyl ester

: 2523-55-9
trans-4-methylcyclohexanamine

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: 1335139-10-0
[1-(trans-4-methylcyclohexyl)-1H-imidazol-4-yl]methanol

Conditions

Conditions	Yield
Stage #1: acetic acid 2-isocyanoethyl ester; N,N-dimethyl-formamide dimethyl acetal In methanol at 5 - 10℃; for 4h; Stage #2: trans-4-methylcyclohexanamine In methanol; water at 0 - 65℃; for 24h; Stage #3: With sodium bis(2-methoxyethoxy)aluminium dihydride In toluene at 0 - 20℃; for 1h;	64.2%
Stage #1: acetic acid 2-isocyanoethyl ester; N,N-dimethyl-formamide dimethyl acetal In methanol at 5 - 10℃; for 4h; Stage #2: trans-4-methylcyclohexanamine In methanol; water at 0 - 65℃; for 24h; Stage #3: With sodium bis(2-methoxyethoxy)aluminium dihydride In toluene at 0 - 20℃; for 1h;	64.2%

...Expand

: 1028809-96-2
C18(2)H5H18SO6N3

: 2523-55-9
trans-4-methylcyclohexanamine

: (2)H5-glimepiride

Conditions

Conditions	Yield
In 1,4-dioxane at 100℃;	64%

: 2523-55-9
trans-4-methylcyclohexanamine

: 98296-25-4
4-chloro-2-(pyridin-3-yl)quinazoline

: trans-N-(4-methylcyclohexyl)-2-(pyridin-3-yl)quinazolin-4-amine

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide	55%

: 247564-66-5
4,6-difluoro-1H-4ndole-2-carboxylic acid

: 2523-55-9
trans-4-methylcyclohexanamine

: 1473450-35-9
4,6-difluoro-N-(trans-4-methylcyclohexyl)-1H-indole-2-carboxamide

Conditions

Conditions	Yield
Stage #1: 4,6-difluoro-1H-indole-2-carboxylic acid With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In N,N-dimethyl-formamide at 20℃; for 0.166667h; Stage #2: trans-4-methylcyclohexanamine In N,N-dimethyl-formamide at 20℃; for 16h;	52%

: 2523-55-9
trans-4-methylcyclohexanamine

: 4-(5-(ethylsulfonimidoyl)-2-fluorophenyl)-6-methyl-1-toluenesulfonyl-1,6-dihydro-7H-pyrrolo[2, 3-c]pyridine-7-one

: 4-(5-(S-ethylsulfonimidoyl)-2-((trans-4-methylcyclohexyl)amino)phenyl)-6-methyl-1,6-dihydro-7H-pyrrolo[2 ,3-c]pyridine-7-one

Conditions

Conditions	Yield
at 150℃; for 1h; Sealed tube;	36%

: 2523-55-9
trans-4-methylcyclohexanamine

: 4-methyl-1H-pyrrolo[2,3-b]pyridine-2-carbonyl chloride

: 4-methyl-N-(4-methylcyclohexyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 25℃; for 2h;	33.97%

: 2523-55-9
trans-4-methylcyclohexanamine

: 4-fluoro-1H-pyrrolo[2,3-b]pyridine-2-carbonyl chloride

: 4-fluoro-N-(4-methylcyclohexyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 25℃; for 3h; Inert atmosphere;	15.31%

: 2523-55-9
trans-4-methylcyclohexanamine

: 32175-04-5
trans-4-benzamino-1-methyl-cyclohexane

Conditions

Conditions	Yield
durch Benzoylierung;

: 2523-55-9
trans-4-methylcyclohexanamine

: 2523-67-3
dimethyl-(trans-4-methyl-cyclohexyl)-amine

: 2523-55-9
trans-4-methylcyclohexanamine

: 103-71-9
phenyl isocyanate

: 92374-00-0
N-(4-methyl-cyclohexyl)-N'-phenyl-urea

trans-4-Methylcyclohexyl amine Specification

The CAS register number of Cyclohexanamine,4-methyl-, trans- is 2523-55-9. It also can be called as 4-trans-Methylcyclohexylamine and the systematic name about this chemical is trans-4-methylcyclohexanamine. The molecular formula about this chemical is C₇H₁₅N and the molecular weight is 113.20.

Physical properties about Cyclohexanamine,4-methyl-, trans- are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): -1; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 26.02Å²; (12)Index of Refraction: 1.449; (13)Molar Refractivity: 35.931 cm³; (14)Molar Volume: 134.017 cm³; (15)Polarizability: 14.244x10^-24cm³; (16)Surface Tension: 28.424 dyne/cm; (17)Enthalpy of Vaporization: 38.624 kJ/mol; (18)Boiling Point: 149.324 °C at 760 mmHg; (19)Vapour Pressure: 4.049 mmHg at 25°C.

Preparation: this chemical can be prepared by N-allyl-N-(4-methylcyclohexyl)allylamine. This reaction will need reagent 2-mercaptobenzoic acid, Pd(dba)₂, DPPB and solvent tetrahydrofuran. The reaction time is 30 min with reaction temperature of 60 °C. The yield is about 97%.

Uses of Cyclohexanamine,4-methyl-, trans-: it can be used to produce N-(4-methyl-cyclohexyl)-3-phenyl-acrylamide with 3-phenyl-acryloyl chloride at ambient temperature. This reaction will need solvent benzene. The yield is about 73%.

When you are using this chemical, please be cautious about it as the following:
This chemical is flammable and it is irritating to eyes. When you are using it, please keep away from sources of ignition. After contact with skin, wash immediately with plenty of soap-suds.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@H]1CC[C@H](N)CC1
(2)InChI: InChI=1/C7H15N/c1-6-2-4-7(8)5-3-6/h6-7H,2-5,8H2,1H3/t6-,7-
(3)InChIKey: KSMVBYPXNKCPAJ-LJGSYFOKBM
(4)Std. InChI: InChI=1S/C7H15N/c1-6-2-4-7(8)5-3-6/h6-7H,2-5,8H2,1H3/t6-,7-
(5)Std. InChIKey: KSMVBYPXNKCPAJ-LJGSYFOKSA-N

Product Name

trans-4-Methylcyclohexyl amine

Synthetic route

trans-4-Methylcyclohexyl amine Specification

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