2-Amino-4,6-dichlorophenol

C₆H₅Cl₂NOCAS 527-62-8178.01 g/mol

Open in Covalent MOL file

Aryl halide Phenol Primary amine

Properties

Molecular formula: C₆H₅Cl₂NO
Molar mass: 178.01 g/mol
Exact mass: 176.9748 Da
Melting point: 95.5 °C
logP: 2.28Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Danger

H301 Toxic if swallowed66.7% of notifiers
H302 Harmful if swallowed33.3% of notifiers
H311 Toxic in contact with skin33.3% of notifiers
H312 Harmful in contact with skin33.3% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H331 Toxic if inhaled33.3% of notifiers
H332 Harmful if inhaled33.3% of notifiers
H335 May cause respiratory irritation33.3% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

527-62-8

SMILES

Nc1cc(Cl)cc(Cl)c1O

InChIKey

WASQBNCGNUTVNI-UHFFFAOYSA-N

InChI

InChI=1S/C6H5Cl2NO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H,9H2

Weigh it out

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

Names and synonyms

7 names

Phenol, 2-amino-4,6-dichloro-
2,4-Dichloro-6-aminophenol
4,6-Dichloro-o-aminophenol
4,6-Dichloro-2-aminophenol
6-Amino-2,4-dichlorophenol
NSC 658464
2-Amino-4,6-dichloro-1-hydroxybenzene

Work with 2-Amino-4,6-dichlorophenol

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

2,4,6-Trichlorophenol88-06-267 % similar 2-Amino-6-chlorophenol38191-33-257 % similar 2,4-Dichloro-6-methylphenol1570-65-653 % similar Bithionol97-18-753 % similar 3-Amino-5-chloro-2-hydroxybenzenesulfonic acid88-23-351 % similar 4-Amino-2,6-dichlorophenol5930-28-950 % similar 2-Amino-4-chloro-6-nitrophenol6358-08-350 % similar 2-Amino-6-chloro-4-nitrophenol6358-09-450 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Dichloro-4-pyridinemethanol101990-69-6 Nicotinic acid chloride hydrochloride20260-53-1 Isonicotinoyl chloride hydrochloride39178-35-3 5-Amino-2,4-dichlorophenol39489-79-7 Picolinoyl chloride hydrochloride39901-94-5 4-Amino-2,5-dichlorophenol50392-39-7 (5,6-Dichloropyridin-3-yl)methanol54127-30-9 (2,6-Dichloro-3-pyridinyl)methanol55304-90-0

Elsewhere

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