Menthyl nicotinate, (±)-

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C16H23NO2
Molecular Weight	261.3593
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Menthyl nicotinate, (±)-

Structure Search

SMILES

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C2=CN=CC=C2

InChI

InChIKey=GGOHHUHCISYDOX-VHDGCEQUSA-N

InChI=1S/C16H23NO2/c1-11(2)14-7-6-12(3)9-15(14)19-16(18)13-5-4-8-17-10-13/h4-5,8,10-12,14-15H,6-7,9H2,1-3H3/t12-,14+,15-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Menthyl nicotinate, (±)-

Common Name

English

Nicotinyl racementhol

Preferred Name

English

3-Pyridinecarboxylic acid, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1?,2?5?)-

Systematic Name

English

5-METHYL-2-(1-METHYLETHYL)CYCLOHEXYL 3-PYRIDINECARBOXYLATE

Systematic Name

English

5-METHYL-2-(ISOPROPYL)CYCLOHEXYL NICOTINATE

Systematic Name

English

3-Pyridinecarboxylic acid, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1?,2?,5?)-

Systematic Name

English

3-Menthyl nicotinate

Systematic Name

English

NICOTINIC ACID MENTHOL ESTER

Systematic Name

English

3-Pyridinecarboxylic acid, 5-methyl-2-(1-methylethyl)cyclohexyl ester

Systematic Name

English

racementhol nicotinate

Common Name

English

Code System Code Type Description

CAS

52528-12-8

Created by admin on Wed Apr 02 08:40:57 GMT 2025 , Edited by admin on Wed Apr 02 08:40:57 GMT 2025

PRIMARY

ECHA (EC/EINECS)

254-991-1

Created by admin on Wed Apr 02 08:40:57 GMT 2025 , Edited by admin on Wed Apr 02 08:40:57 GMT 2025

PRIMARY

EPA CompTox

DTXSID101023751

Created by admin on Wed Apr 02 08:40:57 GMT 2025 , Edited by admin on Wed Apr 02 08:40:57 GMT 2025

PRIMARY

CAS

40594-65-8

Created by admin on Wed Apr 02 08:40:57 GMT 2025 , Edited by admin on Wed Apr 02 08:40:57 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

XF9Y6AK57V

Created by admin on Wed Apr 02 08:40:57 GMT 2025 , Edited by admin on Wed Apr 02 08:40:57 GMT 2025

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WIKIPEDIA

Menthyl nicotinate

Created by admin on Wed Apr 02 08:40:57 GMT 2025 , Edited by admin on Wed Apr 02 08:40:57 GMT 2025

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SUBSTANCE RECORD


					XF9Y6AK57V

Menthyl nicotinate, (±)-