기본 정보
- CAS
2818-69-1- 표준 SMILES
Cc1nc2ccc(Cl)cc2[nH]1- InChIKey
NICFDLORAOTXMD-UHFFFAOYSA-N- 분자식
- C8H7ClN2
- 평균 분자량
- 166.61 g/mol
- 단동위원소 질량
- 166.0297759
개요
5-chloro-2-methyl-1h-benzimidazole appears as light brown solid or fluffy powder. (NTP, 1992)
이름 및 식별자
- 우선 이름
- 5-Chloro-2-methylbenzimidazole
- IUPAC
- 6-chloro-2-methyl-1H-benzimidazole
- 현지명
- 5-클로로-2-메틸벤즈이미다졸
- 영어명
- 5-Chloro-2-methylbenzimidazole
- 분자식
- C8H7ClN2
- 분자량
- 166.61
이름 및 동의어
5-Chloro-2-methylbenzimidazole5-Chloro-2-methyl-1H-benzimidazole1H-Benzimidazole, 6-chloro-2-methyl-DTXSID8024787EINECS 220-575-3NSC 60139UNII-XV988Z010HXV988Z010HNSC-601395-Chloro-2-methyl-1H-benzoimidazoleDTXCID004787CHLORO-2-METHYL-1H-BENZIMIDAZOLE, 5-
이름 더 보기
5-클로로-2-메틸벤즈이미다졸6-CHLORO-2-METHYL-1H-BENZO[D]IMIDAZOLE5-chloro-2-methyl-1h-benzimidazolBenzimidazole, 5-chloro-2-methyl-2-Methyl-6-chloro-1H-benzimidazole2-Methyl-5-chloro-1H-benzimidazole5(6)-chloro 2-Methyl benziMidazole
RosalinRefChem:102319BENZIMIDAZOLE, 6-CHLORO-2-METHYL-NICFDLORAOTXMD-UHFFFAOYSA-N2818-69-15-chloro-2-methyl-1H-benzo[d]imidazole2-Methyl-5-chlorobenzimidazole6-chloro-2-methyl-1H-benzimidazole
데이터베이스 식별자
- CAS
2818-69-1- PubChem CID
- 76063
물성
구조 계산 물성
- XLogP
- 2.7
- 극성 표면적
- 28.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 151
실험 및 물리화학적 성질
Solubilityless than 1 mg/mL at 70.7 °F (NTP, 1992)
Melting Point387 °F (NTP, 1992)
Physical Description5-chloro-2-methyl-1h-benzimidazole appears as light brown solid or fluffy powder. (NTP, 1992)
물리화학적 성질
- 녹는점
- 197 °C · 197°C
- 끓는 점
- 374.7 · 374.7±15.0 °C(Predicted)
- 밀도
- 1.351 · 1.351±0.06 g/cm3(Predicted)
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 메탄올에 용해됨
- 물리적 상태
- powder to crystal
- 산도 계수 (pKa)
- 10.57 · 10.57±0.10(Predicted)
- 색상
- Light yellow to Yellow to Orange
- 수용성
- 21.5 · 21.5&C에서 <0.1g/100mL
- 안정성
- 안정적인. 타기 쉬운. 강한 산화제와 호환되지 않습니다.
- EPA
- 5 · 5-Chloro-2-methylbenzimidazole (2818-69-1)
화학적 성질
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile
Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 및 보호
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
화학 및 산업
용도 및 제조
General Manufacturing Information1H-Benzimidazole, 6-chloro-2-methyl-: INACTIVE
응용 분야
일반 설명Light brown solid or fluffy powder.
공급사66 곳
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