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52671-64-4

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Basic Information
CAS No.: 52671-64-4
Name: 4-Amino-3-chlorophenol hydrochloride
Molecular Structure:
Molecular Structure of 52671-64-4 (4-Amino-3-chlorophenol hydrochloride)
Formula: C6H6ClNO.HCl
Molecular Weight: 180.034
Synonyms: Phenol,4-amino-3-chloro-, hydrochloride (9CI);2-Chloro-4-hydroxyanilinehydrochloride;3-Chloro-4-aminophenol hydrochloride;
EINECS: 610-882-4
Density: 1.406g/cm3
Melting Point: 255 °C (dec.)(lit.)
Boiling Point: 314 °C at 760 mmHg
Flash Point: 143.7 °C
Appearance: GREY TO BROWN POWDER, CRYSTALS, CRYSTALLINE POWDER AND/OR CHUNKS
Hazard Symbols: R36/37/38:;
Risk Codes: 36/37/38
Safety: 26-36
PSA: 46.25000
LogP: 3.01100
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Chemistry

Molecular Structure of Phenol,4-amino-3-chloro-, hydrochloride (1:1) (CAS No. 52671-64-4):

Systematic Name: 4-Amino-3-chlorophenol hydrochloride (1:1)    
Synonyms: 2-Chloro-4-hydroxyaniline hydrochloride  
Molecular Formula: C6H6ClNO.HCl
Molecular Weight: 180.03
CAS Registry Number: 52671-64-4
Melting Point: 255 °C (dec.)(lit.)
Flash Point: 143.7 °C
Enthalpy of Vaporization: 57.73 kJ/mol
Boiling Point: 314 °C at 760 mmHg
Vapour Pressure: 0.000259 mmHg at 25°C
Structure Descriptors of Phenol,4-amino-3-chloro-, hydrochloride (1:1) (CAS No. 52671-64-4):
SMILES: Cl.Oc1cc(Cl)c(N)cc1
InChI: InChI=1/C6H6ClNO.ClH/c7-5-3-4(9)1-2-6(5)8;/h1-3,9H,8H2;1H
InChIKey: RFJVQGMBFQGZPV-UHFFFAOYAU
Std. InChI: InChI=1S/C6H6ClNO.ClH/c7-5-3-4(9)1-2-6(5)8;/h1-3,9H,8H2;1H
Std. InChIKey: RFJVQGMBFQGZPV-UHFFFAOYSA-N

Safety Profile

Safety Information of Phenol,4-amino-3-chloro-, hydrochloride (1:1) (CAS No. 52671-64-4):
Hazard Codes: Xi Irritant
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3