2,6-Dichloro-4-nitrophenol

HCID 12066CAS 618-80-4

기본 정보

표준 SMILES: O=[N+]([O-])c1cc(Cl)c(O)c(Cl)c1
InChIKey: PXSGFTWBZNPNIC-UHFFFAOYSA-N
분자식: C6H3Cl2NO3
평균 분자량: 208 g/mol
단동위원소 질량: 206.94899832

이름 및 식별자

우선 이름: 2,6-Dichloro-4-nitrophenol
IUPAC: 2,6-dichloro-4-nitrophenol
영어명: 2,6-Dichloro-4-nitrophenol
분자식: C6H3Cl2NO3
분자량: 208

이름 및 동의어

2,6-DICHLORO-4-NITROPHENOL618-80-4Phenol, 2,6-dichloro-4-nitro-4-Nitro-2,6-dichlorophenolDCNPDTXSID6060686AI3-03649NSC-412336WLM45T7LRefChem:445418DTXCID0043137210-563-6

이름 더 보기

2,6-Dichloro-4-nitro6-dichloro-4-nitrophenol2,6-Chloro-4-nitrophenol2,6-dichloro-4-nitro-pheno2,6-dichloro-p-nitrophenolCyhalofop-butyl Impurity 4Dichloro Nitro Phenol (DCNP)2,6-dichloro-4-nitrophenolate

MFCD000147152,6-dichloro-4-nitro-phenol2-6-Dichloro-4-nitrophenolNSC4123NSC 4123EINECS 210-563-62,6-Dichloro4-nitrophenolPhenol,6-dichloro-4-nitro-

데이터베이스 식별자

CAS: 618-80-4
PubChem CID: 12066
DTXSID: DTXSID6060686
UNII: 36WLM45T7L
EC Number: 210-563-6
Nikkaji: J134.680F

물성

구조 계산 물성

XLogP: 2.9
극성 표면적: 66.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 12
형식 전하: 0
복잡도: 172

실험 및 물리화학적 성질

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

LogP2.96

물리화학적 성질

녹는점: 123 · 123-126 °C (dec.)
끓는 점: 285.2 · 285.2±40.0 °C(Predicted)
밀도: 1.822 · 1.8220
굴절률: 1.565 · 1.5650 (estimate)
저장 조건: 2 · Storage temp. 2-8°C
용해도: 메탄올에 용해됨
물리적 상태: powder to crystal
산도 계수 (pKa): 3.81 · 3.81±0.44(Predicted)
색상: Light orange to Yellow to Green
BRN: 1245045 · 1245045
InChI: 1S/C6H3Cl2NO3/c7-4-1-3(9(11)12)2-5(8)6(4)10/h1-2,10H
InChIKey: PXSGFTWBZNPNIC-UHFFFAOYSA-N
SMILES: Oc1c(Cl)cc(cc1Cl)[N+]([O-])=O
EPA: 2 · Phenol, 2,6-dichloro-4-nitro- (618-80-4)

화학적 성질

yellow crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (97.8%): 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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (97.8%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 2811 6.1/PG 1
HS 번호: 29089990
risk_code: 20/21/22-36/37/38
hazard_code: Xn
safety_code: 26-36-36/37/39
포장분류: III
위험 등급: 4.1
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

용도 및 제조

General Manufacturing InformationPhenol, 2,6-dichloro-4-nitro-: INACTIVE

상·하류 제품 정보

상류 원료

염소산칼륨

하류 제품

TERT-BUTYL 3-(4-AMINO-2,6-DICHLOROPHENOXY)PROPYLCARBAMATE 1-(3-(4-AMINO-2,6-DICHLOROPHENOXY)PROPYL)PYRROLIDIN-2-ONE 2,6-디클로로-4-니트로아니솔 Benzene, 1,3-dichloro-2-ethoxy-5-nitro-4-(2-(N-BENZYL-N-METHYLAMINO)ETHOXY)-3,5-DICHLOROBENZENAMINE 4-아미노-2,6-디클로로페놀 1-(4-AMINO-2,6-DICHLOROPHENOXY)-3-MORPHOLINOPROPAN-2-OL 4-(2-(PIPERIDIN-1-YL)ETHOXY)-3,5-DICHLOROBENZENAMINE 4-(1-BENZYLPIPERIDIN-4-YLOXY)-3,5-DICHLOROBENZENAMINE 4-((4-BENZYLMORPHOLIN-2-YL)METHOXY)-3,5-DICHLOROBENZENAMINE 4-(3-MORPHOLINOPROPOXY)-3,5-DICHLOROBENZENAMINE 4-(2-MORPHOLINOETHOXY)-3,5-DICHLOROBENZENAMINE

공급사50 곳

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