CAS 33252-64-1 3-Nitro-5-(trifluoromethyl)pyridin-2-ol (HCID 2775093)

기본 정보

CAS: 33252-64-1
표준 SMILES: O=c1[nH]cc(C(F)(F)F)cc1[N+](=O)[O-]
InChIKey: JYXKHKBZLLIWEV-UHFFFAOYSA-N
분자식: C6H3F3N2O3
평균 분자량: 208.09 g/mol
단동위원소 질량: 208.00957662

이름 및 식별자

우선 이름: 3-Nitro-5-(trifluoromethyl)pyridin-2-ol
IUPAC: 3-nitro-5-(trifluoromethyl)-1H-pyridin-2-one
영어명: 2-Hydroxy-5-nitro-3-(trifluoromethyl)pyridine
분자식: C6H3F3N2O3
분자량: 208.09

이름 및 동의어

3-nitro-5-(trifluoromethyl)pyridin-2-ol3-Nitro-5-(trifluoromethyl)-2(1H)-pyridinoneRefChem:504444692-913-133252-64-12-HYDROXY-3-NITRO-5-(TRIFLUOROMETHYL)PYRIDINE3-nitro-5-(trifluoromethyl)pyridin-2(1H)-one1851650-55-93-nitro-5-(trifluoromethyl)-1H-pyridin-2-oneMFCD001531933-nitro-5-trifluoromethyl-pyridin-2-ol3-nitro-5-trifluoromethylpyridin-2-ol

이름 더 보기

5-NITRO-3-(TRIFLUOROMETHYL)PYRIDIN-2-OLBUTTPARK 25\01-342-hydroxy-3-nitro-5-trifluoropyridine3-Nitro-5-(trifluoroMethyl)pyridin-2-o5-NITRO-3-(TRIFLUOROMETHYL-2-PYRIDONE)3-NITRO-5-(TRIFLUOROMETHYL)-2-PYRIDONE5-(trifluoromethyl)-3-nitropyridin-2-ol3-Nitro-5-(trifluoromethyl)-2-pyridinol

2-hydroxy-3-nitro-5-trifluoromethylpyridine3-NITRO-5-TRIFLUOROMETHYL-2-PYRIDINONEAB04090CS-0157385EN300-093813-nitro-5-(trifluoromethyl)hydropyridin-2-one3-Nitro-5-trifluoromethyl-1H-pyridin-2-one2(1H)-Pyridinone, 3-nitro-5-(trifluoromethyl)-

데이터베이스 식별자

CAS: 33252-64-1
PubChem CID: 2775093
DTXSID: DTXSID50379374
EC Number: 692-913-1

물성

구조 계산 물성

XLogP: 0.7
극성 표면적: 74.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 350

물리화학적 성질

녹는점: 189 °C · 189 °C
끓는 점: 276.2 · 276.2±40.0 °C(Predicted)
밀도: 1.61 · 1.61±0.1 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
산도 계수 (pKa): 5.89 · 5.89±0.10(Predicted)
물리적 상태: 고체
색상: 회백색
InChI: InChI=1S/C6H3F3N2O3/c7-6(8,9)3-1-4(11(13)14)5(12)10-2-3/h1-2H,(H,10,12)
InChIKey: JYXKHKBZLLIWEV-UHFFFAOYSA-N
SMILES: C1(=O)NC=C(C(F)(F)F)C=C1[N+]([O-])=O

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, 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

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

ridadr: NA3077
HS 번호: 2933399990
risk_code: 20/21/22-36/37/38
hazard_code: Xi
safety_code: 22-26-36/37/39
위험 등급: 6.1
위험 참고 사항: Irritant

화학 및 산업

상·하류 제품 정보

상류 원료

2-히드록시-5-(트리플루오로메틸)피리딘 2-Amino-3-nitro-5-trifluoromethylpyridine 수산화나트륨

하류 제품

2-Chloro-3-nitro-5-(trifluoromethyl)pyridine

공급사100 곳

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

Suzhou Victorypharm Co.,Ltd.+86-13916956214 · [email protected]

上海赫文斯化工有限公司15721252604 17321035817 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

화합물 노트

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