2-Amino-4-chlorophenol

C₆H₆ClNOCAS 95-85-2143.57 g/mol

Open in Covalent MOL file

Aryl halide Phenol Primary amine

Properties

Molecular formula: C₆H₆ClNO
Molar mass: 143.57 g/mol
Exact mass: 143.0138 Da
Melting point: 140 °C
Flash point: 170 °C
Water solubility: < 1 g/L (20 °C)
logP: 1.63Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed84.5% of notifiers
H315 Causes skin irritation80.4% of notifiers
H317 May cause an allergic skin reaction28.9% of notifiers
H319 Causes serious eye irritation78.4% of notifiers
H335 May cause respiratory irritation76.3% of notifiers
H351 Suspected of causing cancer34% of notifiers

Aggregated from 97 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

95-85-2

SMILES

Nc1cc(Cl)ccc1O

InChIKey

SWFNPENEBHAHEB-UHFFFAOYSA-N

InChI

InChI=1S/C6H6ClNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all

Phenol, 2-amino-4-chloro-
C.I. 76525
C.I. Oxidation base 18
Fouramine PY
p-Chloro-o-aminophenol
1-Amino-2-hydroxy-5-chlorobenzene
1-Hydroxy-2-amino-4-chlorobenzene
2-Hydroxy-5-chloroaniline
4-Chloro-2-aminophenol
5-Chloro-2-hydroxyaniline
o-Amino-p-chlorophenol
4-Chloro-o-aminophenol
NSC 247814

Work with 2-Amino-4-chlorophenol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Amino-5-chlorophenol28443-50-769 % similar 4-Chlorocatechol2138-22-960 % similar 4-Chloro-1,2-phenylenediamine95-83-060 % similar 2,4-Dichlorophenol120-83-256 % similar 2,5-Dichloroaniline95-82-956 % similar 2-Amino-4-chlorothiophenol1004-00-852 % similar 2,2'-Methylenebis(4-chlorophenol)1322-43-652 % similar 4-Chloro-2-methylphenol1570-64-552 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(2-Chloropyridin-4-yl)methanol100704-10-7 3-Chloro-2-methoxypyridine13472-84-9 5-Chloro-2-methoxypyridine13473-01-3 2-Chloro-5-methoxypyridine139585-48-1 3-Amino-4-chlorophenol16026-77-0 2-Chloro-6-methoxypyridine17228-64-7 2-Chloro-4-methoxypyridine17228-69-2 4-Amino-3-chlorophenol17609-80-2

Elsewhere

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