2-Chloro-3-nitropyridine

HCID 79613

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 34515-82-7
Standard SMILES: O=[N+]([O-])c1cccnc1Cl
InChIKey: UUOLETYDNTVQDY-UHFFFAOYSA-N
Molecular formula: C5H3ClN2O2
Average molar mass: 158.54 g/mol
Monoisotopic mass: 157.98830502

Names & identifiers

Preferred name: 2-Chloro-3-nitropyridine
IUPAC: 2-chloro-3-nitropyridine
English name: 2-Chloro-3-nitropyridine
Molecular formula: C5H3ClN2O2
Molecular weight: 158.54

Names & synonyms

2-Chloro-3-nitropyridine5470-18-8Pyridine, 2-chloro-3-nitro-NSC 26279EINECS 226-799-8DTXSID20639293Nitro2chloropyridineRefChem:86200Pyridine, 2chloro3nitroDTXCID4041787226-799-8InChI=1/C5H3ClN2O2/c6-5-4(8(9)10)2-1-3-7-5/h1-3

Show more names

AURORA KA-29972-Chloro-3-nitropyridine97%2-CHLORO-3-NITROPYRIDINE ISO 9001：2015 REACH

UUOLETYDNTVQDY-UHFFFAOYSA-N2-chloro-3-nitro-pyridine34515-82-73-Nitro-2-chloropyridineMFCD00006232PYRIDINE,2-CHLORO-3-NITRO-NSC26279NSC-26279

Database identifiers

CAS: 34515-82-7、5470-18-8
PubChem CID: 79613
DTXSID: DTXSID2063929
ChEMBL: CHEMBL4641778
UNII: 268ZN3SV5X
EC Number: 226-799-8、803-575-3
Nikkaji: J220H

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 58.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 10
Formal charge: 0
Complexity: 136

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Pyridines

SpringerMaterials PropertiesChemical shift

Physical DescriptionLight yellow powder; [Sigma-Aldrich MSDS]

Physicochemical properties

Melting point: 100 · 100-103 °C(lit.)
refractive index: 1.454 · 1.454-1.456
Flash point: 185 °C · 185 °C
CAS DataBase Reference: 34515 · 34515-82-7(CAS DataBase Reference)
Symbol(GHS): 5 · GHS05,GHS06
Signal word: Danger
Hazard statements: 318 · H318-H301
Precautionary statements: 264 · P264-P270-P301+P310-P321-P330-P405-P501-P280-P305+P351+P338-P310
Hazard Codes: Xn
Risk Statements: 20 · 20/22
Safety Statements: 22 · 22-24/25
WGK Germany: 3 · 3

Safety & regulation

GHS classification

GHS Classification · 6 items

Danger

H301 (83.7%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 49 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

Hazard information

Hazards SummaryA skin and strong eye irritant; Toxic by ingestion; [Sigma-Aldrich MSDS]

Hazard Classes and Categories · 2 items

Acute Tox. 3 (83.7%)

Acute Tox. 3 (100%)

Safety data

wgk: 3
risk_code: 20/22
Signal word: Danger
Symbol(GHS): GHS05,GHS06
hazard_code: Xn
safety_code: 22-24/25
Hazard statements: H318-H301
Precautionary statements: P264-P270-P301+P310-P321-P330-P405-P501-P280-P305+P351+P338-P310