1,2,3,4-Tetrahydroquinoline-1-carbonyl chloride

HCID 13591069CAS 2616-50-4

기본 정보

표준 SMILES: O=C(Cl)N1CCCc2ccccc21
InChIKey: KRGMMKVSHXVQCM-UHFFFAOYSA-N
분자식: C10H10ClNO
평균 분자량: 195.64 g/mol
단동위원소 질량: 195.04509162

이름 및 식별자

우선 이름: 1,2,3,4-Tetrahydroquinoline-1-carbonyl chloride
IUPAC: 3,4-dihydro-2H-quinoline-1-carbonyl chloride

이름 및 동의어

1,2,3,4-Tetrahydroquinoline-1-carbonyl ChlorideRefChem:410607896-444-52616-50-41(2H)-Quinolinecarbonyl chloride, 3,4-dihydro-3,4-Dihydroquinoline-1(2H)-carbonyl chloride3,4-dihydro-2h-quinoline-1-carbonyl chloridestarbld0043635SCHEMBL330273SCHEMBL30592391DTXSID10544546KRGMMKVSHXVQCM-UHFFFAOYSA-N

이름 더 보기

CAA61650AKOS017514328DA-075813,4-Dihydroquinolin-1(2H)-carbonyl chlorideG447231,2,3,4-tetrahydroquinolin-1-carbonyl chlorideEN300-1721959

데이터베이스 식별자

CAS: 2616-50-4
PubChem CID: 13591069
DTXSID: DTXSID10544546
EC Number: 896-444-5
Nikkaji: J3.765.573B

물성

구조 계산 물성

XLogP: 2.7
극성 표면적: 20.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 13
형식 전하: 0
복잡도: 207

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.