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87855-72-9

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Basic Information
CAS No.: 87855-72-9
Name: 2-AMINO-4-BROMOPHENOL HCL
Molecular Structure:
Molecular Structure of 87855-72-9 (2-AMINO-4-BROMOPHENOL HCL)
Formula: C6H7BrClNO
Molecular Weight: 224.48288
Synonyms: Phenol,2-amino-4-bromo-, hydrochloride (9CI);2-Amino-4-bromophenol hydrochloride;
Boiling Point: 309 °C at 760 mmHg
Flash Point: 140.7 °C
PSA: 46.25000
LogP: 3.12010
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Specification

The CAS registry number of Phenol,2-amino-4-bromo-, hydrochloride (1:1) is 87855-72-9. This chemical's molecular formula is C6H7BrClNO and molecular weight is 224.48288. Its IUPAC name is called 2-amino-4-bromophenol hydrochloride.

Physical properties of Phenol,2-amino-4-bromo-, hydrochloride (1:1): (1)ACD/LogP: 1.84; (2)ACD/LogD (pH 5.5): 1.83; (3)ACD/LogD (pH 7.4): 1.83; (4)#H bond acceptors: 2; (5)#H bond donors: 3; (6)#Freely Rotating Bonds: 2; (7)Flash Point: 140.7 °C; (8)Enthalpy of Vaporization: 57.17 kJ/mol; (9)Boiling Point: 309 °C at 760 mmHg; (10)Vapour Pressure: 0.00036 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1Br)N)O.Cl
(2)InChI: InChI=1S/C6H6BrNO.ClH/c7-4-1-2-6(9)5(8)3-4;/h1-3,9H,8H2;1H
(3)InChIKey: QPIYEAMFMMNUEX-UHFFFAOYSA-N