기본 정보
- CAS
172648-55-4- 표준 SMILES
CNc1ncc(C(F)(F)F)cc1N- InChIKey
RLRUNZFXEAZVIT-UHFFFAOYSA-N- 분자식
- C7H8F3N3
- 평균 분자량
- 191.15 g/mol
- 단동위원소 질량
- 191.06703192
이름 및 식별자
- 우선 이름
- N2-Methyl-5-(trifluoromethyl)pyridine-2,3-diamine
- IUPAC
- 2-N-methyl-5-(trifluoromethyl)pyridine-2,3-diamine
- 영어명
- 3-AMINO-2-(METHYLAMINO)-5-(TRIFLUOROMETHYL)PYRIDINE
- 분자식
- C7H8F3N3
- 분자량
- 191.15
이름 및 동의어
N2-methyl-5-(trifluoromethyl)pyridine-2,3-diamineRefChem:831537695-966-9172648-55-43-Amino-2-(methylamino)-5-(trifluoromethyl)pyridine3-Amino-2-methylamino-5-(trifluoromethyl)pyridine2-N-methyl-5-(trifluoromethyl)pyridine-2,3-diamineMFCD00068119N2-Methyl-5-(trifluoromethyl)-2,3-pyridinediamineN2-methyl-5-trifluoromethylpyridin-2,3-diaminA1-02439M3215
이름 더 보기
BUTTPARK 145\15-11N2-Methyl-5-(trifluoromethyl)5-(trifluoroMethyl)-N2-Methylpyridine-22,3-Pyridinediamine, N2-methyl-5-(trifluoromethyl)-3-Amino-2-(methylamino)-5-(trifluoromethyl)pyridine97%
5-(TRIFLUOROMETHYL)-N2-METHYLPYRIDINE-2,3-DIAMINE2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)-SCHEMBL115114DTXSID40371029RLRUNZFXEAZVIT-UHFFFAOYSA-NAMY18420N2-Methyl-5-trifluoromethyl-pyridine-2,3-diamineGEO-02846
데이터베이스 식별자
- CAS
172648-55-4- PubChem CID
- 2735930
- DTXSID
DTXSID40371029- EC Number
- 695-966-9
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 50.9 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 171
물리화학적 성질
- 녹는점
- 99 · 99-101°C
- 끓는 점
- 285.5 ° · 285.5°
- 저장 조건
- Keep in dark place,Inert atmosphere,Room temperature
- 용해도
- 메탄올에 용해됨
- 물리적 상태
- powder to crystal
- 색상
- White to Orange to Green
- InChI
- InChI=1S/C7H8F3N3/c1-12-6-5(11)2-4(3-13-6)7(8,9)10/h2-3H,11H2,1H3,(H,12,13)
- InChIKey
- RLRUNZFXEAZVIT-UHFFFAOYSA-N
- SMILES
- C1(NC)=NC=C(C(F)(F)F)C=C1N
안전 및 규제
GHS 분류
GHS Classification
Danger
H302+H312+H332 (25%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (75%)
안전 데이터
- HS 번호
- 2933399990
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xi
- safety_code
- 24/25-36/37/39
- 위험 참고 사항
- Irritant
화학 및 산업
공급사82 곳
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
宁波振岳医药科技有限公司19817745290 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Suzhou Victorypharm Co.,Ltd.+86-13916956214 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
苏州维塔力生物医药有限公司512-68242903 13916956214 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海忝晴化工有限公司
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