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

HCID 12721444

기본 정보

표준 SMILES
COC(=O)C1CCC(CN)CC1
InChIKey
NSIXHHAVJIMVTD-UHFFFAOYSA-N
분자식
C9H17NO2
평균 분자량
171.24 g/mol
단동위원소 질량
171.12592879

이름 및 식별자

우선 이름
(1R,4R)-Methyl 4-(aminomethyl)cyclohexanecarboxylate
IUPAC
methyl 4-(aminomethyl)cyclohexane-1-carboxylate

이름 및 동의어

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
이름 더 보기
Cyclohexanecarboxylicacid, 4-(aminomethyl)-, methyl estertranexamic acid methyl esterTranexamic Acid Impurity 544-aminomethyl-cyclohexanecarboxylic acid methyl esterSCHEMBL1233032SCHEMBL1670447SCHEMBL2375246SCHEMBL9293555

데이터베이스 식별자

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

물성

구조 계산 물성

XLogP
0.6
극성 표면적
52.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
3
무거운 원자 수
12

관련 반응

14건

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