2-Amino-5-bromophenol supplier

Name
2-AMINO-5-BROMOPHENOL
EINECS
CAS No. 38191-34-3
Article Data30
CAS DataBase
Density 1.768 g/cm³
Solubility
Melting Point 146-147 °C
Formula C₆H₆BrNO
Boiling Point 265.046 °C at 760 mmHg
Molecular Weight 188.024
Flash Point 114.096 °C
Transport Information
Appearance white to light yellow solid
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-5-bromophenol;4-Bromo-2-hydroxyaniline;
PSA 46.25000
LogP 2.31810

2-Amino-5-bromophenol Specification

This product is an organic compound with the formula C₆H₆BrNO. The IUPAC name of this chemical is 2-amino-5-bromophenol. With the CAS registry number 38191-34-3, it is also named as Phenol, 2-amino-5-bromo-. It is white to light yellow solid. In addition, the molecular weight is 188.02.

The other characteristics of 2-Amino-5-bromophenol can be summarized as: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 17; (6)ACD/BCF (pH 7.4): 17; (7)ACD/KOC (pH 5.5): 257; (8)ACD/KOC (pH 7.4): 256; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 46.25 Å²; (13)Index of Refraction: 1.677; (14)Molar Refractivity: 40.061 cm³; (15)Molar Volume: 106.328 cm³; (16)Surface Tension: 62.21 dyne/cm; (17)Enthalpy of Vaporization: 52.323 kJ/mol; (18)Vapour Pressure: 0.006 mmHg at 25°C; (19)Tautomer Count: 7; (20)Exact Mass: 186.963276; (21)MonoIsotopic Mass: 186.963276; (22)Topological Polar Surface Area: 46.2; (23)Heavy Atom Count: 9; (24)Complexity: 99.1.

People can use the following data to convert to the molecule structure.
1. SMILES:Oc1cc(Br)ccc1N
2. InChI:InChI=1/C6H6BrNO/c7-4-1-2-5(8)6(9)3-4/h1-3,9H,8H2
3. InChIKey:DRQWUAAWZFIVTF-UHFFFAOYAW
4. Std. InChI:InChI=1S/C6H6BrNO/c7-4-1-2-5(8)6(9)3-4/h1-3,9H,8H2
5. Std. InChIKey:DRQWUAAWZFIVTF-UHFFFAOYSA-N

Product Name

2-AMINO-5-BROMOPHENOL

2-Amino-5-bromophenol Specification

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