(1R,4R)-Methyl 4-(aminomethyl)cyclohexanecarboxylate

HCID 12721444

基本信息

标准SMILES
COC(=O)C1CCC(CN)CC1
InChIKey
NSIXHHAVJIMVTD-UHFFFAOYSA-N
分子式
C9H17NO2
平均分子量
171.24 g/mol
单同位素质量
171.12592879

名称与标识

首选名称
(1R,4R)-Methyl 4-(aminomethyl)cyclohexanecarboxylate
IUPAC
methyl 4-(aminomethyl)cyclohexane-1-carboxylate

名称与别名

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
展开更多名称
Cyclohexanecarboxylicacid, 4-(aminomethyl)-, methyl estertranexamic acid methyl esterTranexamic Acid Impurity 544-aminomethyl-cyclohexanecarboxylic acid methyl esterSCHEMBL1233032SCHEMBL1670447SCHEMBL2375246SCHEMBL9293555

数据库标识

PubChem CID
12721444
Nikkaji
J1.723.739J、J3.151.640D

性质

结构计算性质

XLogP
0.6
极性表面积
52.3 Ų
氢键供体
1
氢键受体
3
可旋转键
3
重原子
12

相关反应

14 条

关联笔记

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