4-Chloro-3-nitropyridine

HCID 2735781CAS 13091-23-1

기본 정보

표준 SMILES: O=[N+]([O-])c1cnccc1Cl
InChIKey: JOTRPRKONYTVBV-UHFFFAOYSA-N
분자식: C5H3ClN2O2
평균 분자량: 158.54 g/mol
단동위원소 질량: 157.988305

이름 및 식별자

우선 이름: 4-Chloro-3-nitropyridine
IUPAC: 4-chloro-3-nitropyridine
영어명: 4-Chloro-3-nitropyridine
분자식: C5H3ClN2O2
분자량: 158.54

이름 및 동의어

4-Chloro-3-nitropyridine13091-23-1Pyridine, 4-chloro-3-nitro-DTXSID90370941RefChem:98452DTXCID10321975603-447-5JOTRPRKONYTVBV-UHFFFAOYSA-N3-nitro-4-chloropyridine4-Chloro-3-nitro-pyridineMFCD026830253-nitro-4-chloro-pyridine

이름 더 보기

4-Chlor-3-nitro-pyridin4-CHLORO-3-NITROPYRIDINE 98%4-chloro-3-nitropyridine, 97%,4-Chloro-3-nitropyridine, tech.4-Chloro-3-nitropyridine ISO 9001：2015 REACH4-CHLORO-3-NITROPYRIDINE 4-CHLORO-3-NITROPYRIDINE

4-chloro-3-nitro pyridine4Chloro-3-nitropyridineVX2ZU89YBD3-Nitro-4-Chloro pyridineSCHEMBL56332SCHEMBL1499409SCHEMBL17113878SCHEMBL30258234

데이터베이스 식별자

CAS: 13091-23-1
PubChem CID: 2735781
DTXSID: DTXSID90370941
UNII: VX2ZU89YBD
EC Number: 603-447-5
Nikkaji: J1.074.889E

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 58.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 10
형식 전하: 0
복잡도: 136

물리화학적 성질

녹는점: 35 · 35-50 °C
끓는 점: 95 °C · 95 °C(Press: 5 Torr)
밀도: 1.489 · 1.489±0.06 g/cm3(Predicted)
저장 조건: -20 °C · -20°C
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 0.56 · 0.56±0.10(Predicted)
물리적 상태: 결정성 분말
색상: 옅은 노랑
수용성: 물에 불용성.
InChI: InChI=1S/C5H3ClN2O2/c6-4-1-2-7-3-5(4)8(9)10/h1-3H
InChIKey: JOTRPRKONYTVBV-UHFFFAOYSA-N
SMILES: C1=NC=CC(Cl)=C1[N+]([O-])=O

화학적 성질

Snuff color to brown powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (89.4%): Toxic if swallowed [Danger Acute toxicity, oral]；H318 (89.4%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (10.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (10.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P337+P317, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (89.4%)；Eye Dam. 1 (89.4%)

안전 데이터

wgk: 3
ridadr: UN 2811
HS 번호: 29333990
risk_code: 20/21/22-36/37/38-41-22
hazard_code: Xi,Xn
safety_code: 26-36/37/39-36/39-37/38-36
포장분류: III
위험 등급: IRRITANT, KEEP COLD
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 3 OralEye Dam. 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야

용도4-Chloro-3-nitropyridine (cas# 13091-23-1) is a compound useful in organic synthesis.

공급사50 곳

南京波普生物医药研发有限公司025-87138562 18951783565 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

INTATRADE GmbH+49 3493/605464 · [email protected]

宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]

爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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