Basic information
- Standard SMILES
COC(=O)C1CCC(CN)CC1- InChIKey
NSIXHHAVJIMVTD-UHFFFAOYSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- (1R,4R)-Methyl 4-(aminomethyl)cyclohexanecarboxylate
- IUPAC
- methyl 4-(aminomethyl)cyclohexane-1-carboxylate
Names & synonyms
50738-63-123199-14-6(1R,4R)-METHYL 4-(AMINOMETHYL)CYCLOHEXANECARBOXYLATEmethyl 4-(aminomethyl)cyclohexanecarboxylatetrans-Methyl 4-(aminomethyl)cyclohexanecarboxylateMETHYL 4-(AMINOMETHYL)CYCLOHEXANE-1-CARBOXYLATEmethyl (1r,4r)-4-(aminomethyl)cyclohexane-1-carboxylateMethyl trans-4-(aminomethyl)cyclohexanecarboxylate43087-37-2cis-Methyl 4-(aminomethyl)cyclohexanecarboxylatecyclohexanecarboxylic acid, 4-(aminomethyl)-, methyl ester, hydrochlorideMFCD12965034
Show more names
Cyclohexanecarboxylicacid, 4-(aminomethyl)-, methyl estertranexamic acid methyl esterTranexamic Acid Impurity 544-aminomethyl-cyclohexanecarboxylic acid methyl esterSCHEMBL1233032SCHEMBL1670447SCHEMBL2375246SCHEMBL9293555
Database identifiers
- PubChem CID
- 12721444
- Nikkaji
- J1.723.739J、J3.151.640D
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
Related reactions
14 records
Linked notes
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