2-Chloro-4-methoxyaniline

HCID 407432

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 29242-84-0
Standard SMILES: COc1ccc(N)c(Cl)c1
InChIKey: LNEVUNYUJNORRV-UHFFFAOYSA-N
Molecular formula: C7H8ClNO
Average molar mass: 157.6 g/mol
Monoisotopic mass: 157.02944156

Names & identifiers

Preferred name: 2-Chloro-4-methoxyaniline
IUPAC: 2-chloro-4-methoxyaniline
English name: 4-Methoxy-2-chloroaniline
Molecular formula: C7H8ClNO
Molecular weight: 157.6

Names & synonyms

2-chloro-4-methoxyaniline29242-84-0DTXSID60328176RefChem:258783DTXCID70279286881-654-12-chloro-4-methoxyphenylamineMFCD002096392-chloro-4-methoxy-anilineBenzenamine, 2-chloro-4-methoxy-2-chloro-4-methoxybenzenamine3-Chloranisidin

Show more names

5 graMs2-Chloro-4-methoxyan2-Chloro-4-methoxyaniline 97+%BenzenaMine,2-chloro-4-Methoxy-4-AMino-3-chloroanisole[2-Chloro-4-Methoxyaniline]

4-Methoxy-2-chloroaniline4-amino-3-chloroanisole2-Chloro-4-methoxy-phenylamineBenzenamine,2-2-Chloro-p-anisidine3-chloro-4-anisidineSCHEMBL9229662-Chloro-4-(methyloxy)aniline

Database identifiers

CAS: 29242-84-0
PubChem CID: 407432
DTXSID: DTXSID60328176
EC Number: 881-654-1
Nikkaji: J160.868A

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 35.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 110

Physicochemical properties

Melting point: 114 ℃ · 114℃
Boiling point: 249 ℃ · 249℃
Density: 1.234 · 1.234
Flash point: 105 ℃ · 105℃
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
pka: 3.26 · 3.26±0.10(Predicted)
Appearance: Brown to black Liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H332-H312
Precautionary statements: 280 · P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
HS Code: 2921420090 · 2921420090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code: 2921420090
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H332-H312
Precautionary statements: P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312