퀴놀린,4-(클로로메틸)-2-메틸-(9CI)

4-(Chloromethyl)-2-methylquinoline

HCID 11535719

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 288399-19-9
표준 SMILES: Cc1cc(CCl)c2ccccc2n1
InChIKey: GRCWGPJQMVGBNY-UHFFFAOYSA-N
분자식: C11H10ClN
평균 분자량: 191.65 g/mol
단동위원소 질량: 191.050177

이름 및 식별자

우선 이름: 4-(Chloromethyl)-2-methylquinoline
IUPAC: 4-(chloromethyl)-2-methylquinoline
현지명: 퀴놀린,4-(클로로메틸)-2-메틸-(9CI)
영어명: Quinoline, 4-(chloromethyl)-2-methyl- (9CI)
분자식: C11H10ClN
분자량: 191.66

이름 및 동의어

4-(chloromethyl)-2-methylquinoline288399-19-9DTXSID40468180RefChem:288704DTXCID50418999869-493-54-Chloromethyl-2-methylquinoline4-chloromethyl-2-methyl-quinolineQuinoline, 4-(chloromethyl)-2-methyl-MFCD067976942-Methyl-4-(chloromethyl)quinoline4-(chloromethyl)-2-methyl-quinoline

이름 더 보기

퀴놀린,4-(클로로메틸)-2-메틸-(9CI)Quinoline, 4-(chloromethyl)-2-methyl4-(Chloromethyl)-2-methyl-1-azanaphthaleneQuinoline, 4-(chloromethyl)-2-methyl- (9CI)

SCHEMBL9945972-methyl-4-chloromethylquinoline4-chloromethyl-2methyl-quinoline4-chloromethyl 2-methyl quinoline4-chloromethyl-2-methyl quinolineGRCWGPJQMVGBNY-UHFFFAOYSA-N4-(chloromethyl) -2-methylquinolineAKOS000352300

데이터베이스 식별자

CAS: 288399-19-9
PubChem CID: 11535719
DTXSID: DTXSID40468180
EC Number: 869-493-5

물성

구조 계산 물성

XLogP: 3
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 171

물리화학적 성질

끓는 점: 316.8 · 316.8±27.0 °C(Predicted)
밀도: 1.192 · 1.192±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa): 5.45 · 5.45±0.50(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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.