기본 정보
- CAS
5958-24-7- 표준 SMILES
[O-][n+]1c(CCl)nc2ccc(Cl)cc2c1-c1ccccc1- InChIKey
KFDNKXWSTFABQT-UHFFFAOYSA-N- 분자식
- C15H10Cl2N2O
- 평균 분자량
- 305.2 g/mol
- 단동위원소 질량
- 304.0170183
개요
intermediate product in preparation of chlorodiazepoxide implicated in causing contact dermatitis; structure given in first source
이름 및 식별자
- 우선 이름
- 2-Chloromethyl-4-phenyl-6-chloroquinazoline 3-oxide
- IUPAC
- 6-chloro-2-(chloromethyl)-3-oxido-4-phenylquinazolin-3-ium
- 현지명
- 6-클로로-2-(클로로에틸)-3-옥시도-4-페닐-퀴나졸린
- 영어명
- 6-Chloro-2-(chloromethyl)-3-oxido-4-phenyl-quinazoline
- 분자식
- C15H10Cl2N2O
- 분자량
- 305.16
이름 및 동의어
5958-24-7Cmpcqo6-chloro-2-(chloromethyl)-4-phenylquinazoline 3-oxideQNG87K56142-Chloromethyl-4-phenyl-6-chloroquinazoline-3-oxideDTXSID002082412-CHLOROMETHYL-4-PHENYL-6-CHLOROQUINAZOLINE 3-OXIDERefChem:541489DTXCID20130732620-225-36-chloro-2-(chloromethyl)-3-oxido-4-phenylquinazolin-3-ium6-chloro-2-(chloromethyl)-4-phenyl-quinazoline
이름 더 보기
6-클로로-2-(클로로에틸)-3-옥시도-4-페닐-퀴나졸린Chlordiazepoxide Impurity BChlordiazepoxide EP-Impurity B6-Chloro-2-(chloromethyl)-4-phenylqChlordiazepoxide Hydrochloride Impurity BChlordiazepoxide Hydrochloride EP Impurity B2-(Chloromethyl)-6-chloro-4-phenylquinazoline 3-oxide6-CHLORO-2-(CHLOROMETHYL)-4-PHENYL QUINAZOLINE-3-OXIDE
6-Chloro-2-(chloromethyl)-3-oxido-4-phenyl-quinazoline6-Chloro-2-chloromethyl-4-phenylquinazoline 3-oxide6-Chloro-2-(chloromethyl)-4-phenylquinazoline-3-oxideQuinazoline, 6-chloro-2-(chloromethyl)-4-phenyl-, 3-oxideUNII-QNG87K5614Chlordiazepoxide EP Impurity BChlordiazepoxide Hydrochloride Imp. B (EP); Chlordiazepoxide Imp. B (EP); 6-Chloro-2-(chloromethyl)-4-phenylquinazoline 3-Oxide; Chlordiazepoxide Hydrochloride Impurity B; Chlordiazepoxide Impurity B; Chlordiazepoxide Impurity BClonazepine EP impurity B
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 38.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 325
물리화학적 성질
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨, 가열)
- 물리적 상태
- 고체
- 색상
- 황백색에서 밝은 노란색까지
화학적 성질
White Yellow Solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Warning
H302 (50%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationREACH registered substance: Quinazoline, 6-chloro-2-(chloromethyl)-4-phenyl-, 3-oxide (EC: 620-225-3)
화학 및 산업
응용 분야
용도Chlordiazepoxide (C327050) derivative.
상·하류 제품 정보
상류 원료
공급사20 곳
艾吉析科技（上海）有限公司17717235263 · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
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