기본 정보
- CAS
124473-12-7- 표준 SMILES
COc1ccnc(CCl)c1C.Cl- InChIKey
WHAGSNVVBXOIGQ-UHFFFAOYSA-N- 분자식
- C8H11Cl2NO
- 평균 분자량
- 208.08 g/mol
- 단동위원소 질량
- 207.02176933
이름 및 식별자
- 우선 이름
- 2-(Chloromethyl)-4-methoxy-3-methylpyridine--hydrogen chloride (1/1)
- IUPAC
- 2-(chloromethyl)-4-methoxy-3-methylpyridine;hydrochloride
- 현지명
- 2-클로로메틸-4-메톡시-3-메틸피리딘염화물
- 영어명
- 2-Chloromethyl-3-Methyl-4-Methoxypyridine
- 분자식
- C8H10ClNO
- 분자량
- 171.62
이름 및 동의어
DTXSID409248122-(Chloromethyl)-4-methoxy-3-methylpyridine--hydrogen chloride (1/1)RefChem:1061524DTXCID301353645124473-12-72-(chloromethyl)-4-methoxy-3-methylpyridine hydrochloride86604-74-2Ilaprazole Impurity HCl2-Chloromethyl-4-methoxy-3-methylpyridine hydrochlorideMFCD03425333Pyridine, 2-(chloromethyl)-4-methoxy-3-methyl-, hydrochloride2-Chloromethyl-4-methoxy-3-methylpyridine HCl
이름 더 보기
2-클로로메틸-4-메톡시-3-메틸피리딘염화물Eprazole impurity 31Ilaprazole Intermediate 1Rabeprazole Mercapto Impurity 12-chloromethyl-3-methyl-4-methoxypyridine-Chloromethyl-4-methoxy-3-methyl-pyridine2-Chloromethyl-4-methoxy-3-methyl-pyridinePyridine, 2-(chloromethyl)-4-methoxy-3-methyl4-Methoxy-3-Methyl-2-Chloromethyl Pyridine HClRabeprazole Impurity 23(Ilaprazole Intermediate 1)
2-(chloromethyl)-4-methoxy-3-methylpyridine;hydrochloride2-Chloromethyl-3-methyl-4-methoxypyridine hydrochlorideWHAGSNVVBXOIGQ-UHFFFAOYSA-N2-(Chloromethyl)-4-methoxy-3-methylpyridine Hydrochloride (1:1); Pyridine, 2-(chloromethyl)-4-methoxy-3-methyl-, hydrochloride (9CI); 2-(Chloromethyl)-4-methoxy-3-methylpyridine hydrochlorideIlaprazole IntermediatesIlaprazole IntermediateRabeprazole impurity 21Rabeprazole Impurity 5 HCl
데이터베이스 식별자
- CAS
124473-12-7、86604-74-2- PubChem CID
- 11513982
- DTXSID
DTXSID40924812
물성
구조 계산 물성
- 극성 표면적
- 22.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 121
물리화학적 성질
- 녹는점
- 145 · 145-149°C (dec.)
- 끓는 점
- 257.5 · 257.5±35.0 °C(Predicted)
- 밀도
- 1.139 · 1.139±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- 용해도
- 클로로포름, 메탄올에 용해됨
- 산도 계수 (pKa)
- 5.29 · 5.29±0.30(Predicted)
- 물리적 상태
- 고체
- 색상
- 하얀색
- InChI
- InChI=1S/C8H10ClNO/c1-6-7(5-9)10-4-3-8(6)11-2/h3-4H,5H2,1-2H3
- InChIKey
- UIRCDHHEYPUZGA-UHFFFAOYSA-N
- SMILES
- C1(CCl)=NC=CC(OC)=C1C
화학적 성질
White Solid
화학 및 산업
응용 분야
용도2-CHLOROMETHYL-4-METHOXY-3-METHYLPYRIDINE HYDROCHLORIDE is used in the preparation of anti-ulcerative agents and other pharmaceutical compounds.
공급사100 곳
湖北万得化工有限公司15377098680 15377098680 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
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上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
珠海海瑞德制药有限公司7737188 13326687259 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]
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