2-Hydroxy-6-methyl-3-nitropyridine

HCID 543029CAS 39745-39-6

기본 정보

표준 SMILES: Cc1ccc([N+](=O)[O-])c(=O)[nH]1
InChIKey: YVYDGIGILRUPED-UHFFFAOYSA-N
분자식: C6H6N2O3
평균 분자량: 154.12 g/mol
단동위원소 질량: 154.03784205

이름 및 식별자

우선 이름: 2-Hydroxy-6-methyl-3-nitropyridine
IUPAC: 6-methyl-3-nitro-1H-pyridin-2-one
영어명: 6-Hydroxy-5-nitro-2-picoline
분자식: C6H6N2O3
분자량: 154.12

이름 및 동의어

39745-39-62-Hydroxy-6-methyl-3-nitropyridineDTXSID90337478RefChem:87462DTXCID80288566625-238-8YVYDGIGILRUPED-UHFFFAOYSA-N6-methyl-3-nitropyridin-2-ol6-Hydroxy-5-nitro-2-picoline6-methyl-3-nitro-1H-pyridin-2-one2-hydroxy-3-nitro-6-methylpyridine6-methyl-3-nitro-2(1h)-pyridinone

이름 더 보기

3-NITRO-6-METHYLPYRIDIN-2-OL6-Methyl-3-nitro-2-pyridinol6-METHYL-3-NITRO-PYRIDIN-2-OLHYDROXY-6-METHYL-3-NITROPYRIDINE6-Hydroxy-5-nitro-2-picoline,99%

MFCD030014142-Hydroxy-3-nitro-6-picoline6-methyl-3-nitro-1,2-dihydropyridin-2-one6-methyl-3-nitropyridin-2(1h)-one6-Methyl-3-nitro-2-pyridinol #AC-23066SY011619N11927

데이터베이스 식별자

CAS: 39745-39-6
PubChem CID: 543029
DTXSID: DTXSID90337478
EC Number: 625-238-8
Nikkaji: J1.584.475B

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 74.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 272

물리화학적 성질

녹는점: 225 · 225-226 C
끓는 점: 277.46 °C · 277.46°C (rough estimate)
밀도: 1.4564 · 1.4564 (rough estimate)
굴절률: 1.51 · 1.5100 (estimate)
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: powder to crystal
산도 계수 (pKa): 8.47 · 8.47±0.10(Predicted)
색상: Light yellow to Brown to Dark green
InChI: 1S/C6H6N2O3/c1-4-2-3-5(8(10)11)6(9)7-4/h2-3H,1H3,(H,7,9)
InChIKey: YVYDGIGILRUPED-UHFFFAOYSA-N
SMILES: Cc1ccc(c(O)n1)[N+]([O-])=O

화학적 성질

Yellow crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 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 (97.6%)

안전 데이터

wgk: 3
HS 번호: 29337900
risk_code: 36/37/38-41-37/38-22
hazard_code: Xi,Xn
safety_code: 37/39-26-36-39
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도2-Hydroxy-6-methyl-3-nitropyridine is a water soluble compound that has been used for the treatment of tuberculosis.

상·하류 제품 정보

상류 원료

2-Amino-3-nitro-6-picoline

하류 제품

2-Methyl-5-nitropyridine 3-Amino-6-methylpyridin-2-ol 6-메틸-2-(1-피페리디닐)-3-피리디나민

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海策嵘生物科技有限公司[email protected]

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

Hong Kong Tiansheng New Material Trading Co., Ltd+8617320695765 · [email protected]

上海腾准生物科技有限公司19821570922 · [email protected]

연결된 노트

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