Isoproterenone hydrochloride

HCID 2830496

노트 반응

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기본 정보

CAS: 16899-81-3
표준 SMILES: CC(C)NCC(=O)c1ccc(O)c(O)c1.Cl
InChIKey: IUNGEEAXDFWWSQ-UHFFFAOYSA-N
분자식: C11H16ClNO3
평균 분자량: 245.7 g/mol
단동위원소 질량: 245.0818711

이름 및 식별자

우선 이름: Isoproterenone hydrochloride
IUPAC: 1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)ethanone;hydrochloride

이름 및 동의어

16899-81-31-(3,4-dihydroxyphenyl)-2-[(1-methylethyl)amino] hydrochlorideNSC-23623X4JS3SRV5YIsoproterenone hydrochlorideEthanone, 1-(3,4-dihydroxyphenyl)-2-[(1-methylethyl)amino]-, hydrochloride (1:1)ACETOPHENONE, 3',4'-DIHYDROXY-2-(ISOPROPYLAMINO)-, HYDROCHLORIDEETHANONE, 1-(3,4-DIHYDROXYPHENYL)-2-((1-METHYLETHYL)AMINO)-, HYDROCHLORIDE (1:1)1-(3,4-Dihydroxyphenyl)-2-((1-methylethyl)amino) hydrochlorideRefChem:2013121-(3,4-DIHYDROXYPHENYL)-2-[(1-METHYLETHYL)AMINO]ETHANONE HYDROCHLORIDE1-(3,4-dihydroxyphenyl)-2-(isopropylamino)ethanone hydrochloride

이름 더 보기

MFCD000350761-(3,4-Dihydroxyphenyl)-2-[(1-methylethyl)amino]-ethanone HydrochlorideIsoprenaline Hydrochloride EP Impurity AMLS-0315678.0001Isoprenaline impurity A CRSorb3181604CHEMBL1736975SCHEMBL11290306

데이터베이스 식별자

CAS: 16899-81-3
PubChem CID: 2830496
DTXSID: DTXSID501367420
ChEMBL: CHEMBL1736975
UNII: X4JS3SRV5Y
EC Number: 240-943-7

물성

구조 계산 물성보충 중

극성 표면적: 69.6 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 4
회전 가능 결합 수: 4
무거운 원자 수: 16
형식 전하: 0
복잡도: 218

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.