4-Azidoaniline

HCID 84674

Notes Reactions

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Basic information

CAS: 14860-64-1
Standard SMILES: [N-]=[N+]=Nc1ccc(N)cc1
InChIKey: SSMVDPYHLFEAJE-UHFFFAOYSA-N
Molecular formula: C6H6N4
Average molar mass: 134.14 g/mol
Monoisotopic mass: 134.05924619

Overview

RN given refers to parent cpd

Names & identifiers

Preferred name: 4-Azidoaniline
IUPAC: 4-azidoaniline
English name: 4-azidoaniline
Molecular formula: C6H6N4
Molecular weight: 134.13864

Names & synonyms

4-Azidoaniline14860-64-1DTXSID80164033para-azidoanilineRefChem:97916DTXCID3086524238-929-0Benzenamine, 4-azido-EINECS 238-929-0CHEMBL3236180SCHEMBL13449658MFCD00655672

Show more names

4-Azidobenzenamine

SY213703NS0002486710.14272/SSMVDPYHLFEAJE-UHFFFAOYSA-NEN300-263940doi:10.14272/SSMVDPYHLFEAJE-UHFFFAOYSA-NF1906-9764

Database identifiers

CAS: 14860-64-1
PubChem CID: 84674
DTXSID: DTXSID80164033
ChEMBL: CHEMBL3236180
EC Number: 238-929-0
Nikkaji: J227.217B

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 40.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 142

Physicochemical properties

Melting point: 65 · 65-66 °C
Symbol(GHS): 6 · GHS06
Signal word: Danger
Hazard statements: 331 · H331-H311-H301
Precautionary statements: 261 · P261-P271-P304+P340-P311-P321-P403+P233-P405-P501-P264-P270-P301+P310-P321-P330-P405-P501-P280-P302+P352-P312-P322-P361-P363-P405-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

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

P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P361+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Safety data

Signal word: Danger
Symbol(GHS): GHS06
Hazard statements: H331-H311-H301
Precautionary statements: P261-P271-P304+P340-P311-P321-P403+P233-P405-P501-P264-P270-P301+P310-P321-P330-P405-P501-P280-P302+P352-P312-P322-P361-P363-P405-P501