CAS 150319-83-8 Methyl 2-(3-aminophenyl)acetate hydrochloride (HCID 44119610)

기본 정보

CAS: 150319-83-8
표준 SMILES: COC(=O)Cc1cccc(N)c1.Cl
InChIKey: OOGVJPZOIXNNHQ-UHFFFAOYSA-N
분자식: C9H12ClNO2
평균 분자량: 201.65 g/mol
단동위원소 질량: 201.0556563

이름 및 식별자

우선 이름: Methyl 2-(3-aminophenyl)acetate hydrochloride
IUPAC: methyl 2-(3-aminophenyl)acetate;hydrochloride
현지명: 메틸2-(3-a미노페닐)아세테이트염산염
영어명: Methyl 2-(3-aMinophenyl)acetate hydrochloride
분자식: C9H12ClNO2
분자량: 201.65008

이름 및 동의어

Methyl 2-(3-aminophenyl)acetate hydrochlorideRefChem:813367696-570-9150319-83-8Methyl 3-aminophenylacetate hydrochloride3-Aminophenylacetic acid methyl ester HClMFCD11501071Methyl 3-aminophenylacetate, HClmethyl 2-(3-aminophenyl)acetate;hydrochloride3-Aminophenylacetic acid methyl ester hydrochlorideMETHYL 2-(3-AMINOPHENYL)ACETATE HCLBenzeneacetic acid, 3-amino-, methyl ester, hydrochloride (1:1)

이름 더 보기

메틸2-(3-a미노페닐)아세테이트염산염Methyl 2-(3-aminophenyl)

3-amino phenylacetic acid methylester hydrochloride3-amino phenylaceticMETHYL 3-AMINOPHENYLACETATE HCLMethyl (3-aminophenyl)acetate hydrochlorideSCHEMBL3949455SCHEMBL6984256DTXSID90657325OOGVJPZOIXNNHQ-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 150319-83-8
PubChem CID: 44119610
DTXSID: DTXSID90657325
EC Number: 696-570-9

물성

구조 계산 물성

극성 표면적: 52.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 159

물리화학적 성질

녹는점: 167 · 167-170 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 결정성 분말
색상: 옅은 분홍색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.