기본 정보
- CAS
25148-68-9- 표준 SMILES
CNc1ccccc1N.Cl.Cl- InChIKey
DKEONVNYXODZRQ-UHFFFAOYSA-N- 분자식
- C7H10N2.2ClH
- 평균 분자량
- 195.09 g/mol
- 단동위원소 질량
- 194.03775374
개요
Crystals (from ethanol); light purple powder. (NTP, 1992)
이름 및 식별자
- 우선 이름
- N-Methyl-o-phenylenediamine dihydrochloride
- IUPAC
- 2-N-methylbenzene-1,2-diamine;dihydrochloride
- 현지명
- N-메틸-1,2-벤젠디아민디히드로클로라이드
- 영어명
- N-Methyl-1,2-benzenediamine dihydrochloride
- 분자식
- C7H12Cl2N2
- 분자량
- 195.09
이름 및 동의어
25148-68-9N-Methyl-1,2-benzenediamine dihydrochlorideN-Methyl-o-phenylenediamine dihydrochloride1,2-Benzenediamine, N-methyl-, dihydrochlorideN-Methyl-1,2-phenylenediamine DihydrochlorideUNII-NML5KQ540IEINECS 246-655-8NML5KQ540IDTXSID50256511-Amino-2-methylaminobenzene DihydrochlorideN-METHYL-1,2-DIAMINOBENZENE DIHYDROCHLORIDEO-PHENYLENEDIAMINE, N-METHYL-, DIHYDROCHLORIDE
이름 더 보기
N-메틸-1,2-벤젠디아민디히드로클로라이드phenylene diamine dihydrochlorideN-METHYL-O-PHENLENEDIAMINE DIHYDROCHLORIDEN-Methyl-1,2-benzendiamine dihydrochloride2-METHYLAMINOANILINE HYDROCHLORIDE-o-phenyLN-Methyl-1N-Methyl-1,2-benzeneTelmisartan Impurity 49
RefChem:163776DTXCID605651246-655-8N1-Methylbenzene-1,2-diamine dihydrochloride2-(Methylamino)aniline dihydrochlorideN-Methylbenzene-1,2-diamine dihydrochlorideN-Methyl-o-phenylenediamine, Dihydrochloride1,2-Benzenediamine, N1-methyl-, hydrochloride (1:2)
물성
구조 계산 물성
- 극성 표면적
- 38.1 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 83
실험 및 물리화학적 성질
Solubilitygreater than or equal to 100 mg/mL at 73 °F (NTP, 1992)
Melting Point376 °F (NTP, 1992)
Physical DescriptionCrystals (from ethanol); light purple powder. (NTP, 1992)
물리화학적 성질
- 녹는점
- 191 °C · 191°C
- 저장 조건
- Inert atmosphere,Room Temperature
- 용해도
- DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 옅은 레드부터 라이트 베이지까지
- 수용성
- 23 · 23&C에서 >=10g/100mL
- InChI
- InChI=1S/C7H10N2.ClH/c1-9-7-5-3-2-4-6(7)8;/h2-5,9H,8H2,1H3;1H
- InChIKey
- IWRJMQUPCKSBFP-UHFFFAOYSA-N
- SMILES
- N(C1C=CC=CC=1N)C.Cl
- EPA
- N-Methyl-o-phenylenediamine dihydrochloride (25148-68-9)
화학적 성질
Redish Powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, 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. 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 GroupSalts, Acidic
Reactivity Profile
N-METHYL-O-PHENYLENEDIAMINE DIHYDROCHLORIDE is an acidic salt. Materials in this group are generally soluble in water. The resulting solutions contain moderate concentrations of hydrogen ions and have pH's of less than 7.0. They react as acids to neutralize bases. These neutralizations generate heat, but less or far less than is generated by neutralization of inorganic acids, inorganic oxoacids, and carboxylic acid. They usually do not react as either oxidizing agents or reducing agents but such behavior is not impossible. Many of these compounds catalyze organic reactions.
Air and Water ReactionsWater soluble.
Hazard Classes and CategoriesAcute Tox. 3 (100%)
안전 및 보호
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
화학 및 산업
용도 및 제조
General Manufacturing Information1,2-Benzenediamine, N1-methyl-, hydrochloride (1:2): INACTIVE
응용 분야
용도N-Methyl-o-phenylenediamine, Dihydrochloride (cas# 25148-68-9) is a compound useful in organic synthesis.
일반 설명Crystals (from ethanol); light purple powder.
상·하류 제품 정보
상류 원료
하류 제품
공급사100 곳
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
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