CAS 5442-34-2 Ethyl 2-phenylacetimidate hydrochloride (HCID 12218775)

기본 정보

CAS: 5442-34-2
표준 SMILES: CCOC(=N)Cc1ccccc1.Cl
InChIKey: IWGUPOMJPZNXGC-UHFFFAOYSA-N
분자식: C10H14ClNO
평균 분자량: 199.68 g/mol
단동위원소 질량: 199.07639175

이름 및 식별자

우선 이름: Ethyl 2-phenylacetimidate hydrochloride
IUPAC: ethyl 2-phenylethanimidate;hydrochloride
영어명: Benzeneethanimidicacid, ethyl ester, hydrochloride (1:1)
분자식: C10H13NO.ClH
분자량: 199.67726

이름 및 동의어

5442-34-2ethyl 2-phenylacetimidate hydrochlorideethyl 2-phenylethanimidate hydrochlorideMFCD12031866ethyl 2-phenylethanimidate;hydrochlorideETHYL 2-PHENYLETHANECARBOXIMIDATE HYDROCHLORIDEethyl 2-phenylethanimidoate hydrochlorideSCHEMBL506846DTXSID30480992IWGUPOMJPZNXGC-UHFFFAOYSA-Nethyl phenylacetimidate hydrochlorideethyl2-phenylacetimidatehydrochloride

이름 더 보기

Benzeneethanimidicacid, ethyl ester, hydrochloride (1:1)

NSC12010NSC-12010ethyl phenyl-acetimidate hydrochlorideEthyl Phenylacetoimidate HydrochlorideAKOS027441806H46843F5224392-Phenyl-acetimidic acid ethyl ester, hydrochloride

데이터베이스 식별자

CAS: 5442-34-2
PubChem CID: 12218775
DTXSID: DTXSID30480992
EC Number: 183-922-7

물성

구조 계산 물성

극성 표면적: 33.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 4
무거운 원자 수: 13
형식 전하: 0
복잡도: 139

물리화학적 성질

녹는점: 94 · 94-96 °C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.