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Basic Information
CAS No.: 86232-54-4
Name: 4-BROMO-6METHYL-2-METHOXY PHENOL
Molecular Structure:
Molecular Structure of 86232-54-4 (4-BROMO-6METHYL-2-METHOXY PHENOL)
Formula: C8H9BrO2
Molecular Weight: 217.062
Synonyms: 4-BROMO-6METHYL-2-METHOXY PHENOL;4-Bromo-6-methyl-2-methox...
Density: 1.503 g/cm3
Boiling Point: 267.9 °C at 760 mmHg
Flash Point: 115.8 °C
PSA: 29.46000
LogP: 2.47170
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Specification

The CAS register number of 4-Bromo-6-methyl-2-methoxyphenol is 86232-54-4. The systematic name about this chemical is 4-bromo-2-methoxy-6-methylphenol. The molecular formula about this chemical is C8H9BrO2 and the molecular weight is 217.06.

Physical properties about 4-Bromo-6-methyl-2-methoxyphenol are: (1)ACD/LogP: 2.77; (2)ACD/LogD (pH 5.5): 2.77; (3)ACD/LogD (pH 7.4): 2.77; (4)ACD/BCF (pH 5.5): 75.6; (5)ACD/BCF (pH 7.4): 75.28; (6)ACD/KOC (pH 5.5): 769.6; (7)ACD/KOC (pH 7.4): 766.3; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 18.46Å2; (12)Index of Refraction: 1.569; (13)Molar Refractivity: 47.32 cm3; (14)Molar Volume: 144.3 cm3; (15)Polarizability: 18.76x10-24cm3; (16)Surface Tension: 41.8 dyne/cm; (17)Enthalpy of Vaporization: 52.64 kJ/mol; (18)Boiling Point: 267.9 °C at 760 mmHg; (19)Vapour Pressure: 0.0048 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(c(O)c(OC)c1)C
(2)InChI: InChI=1/C8H9BrO2/c1-5-3-6(9)4-7(11-2)8(5)10/h3-4,10H,1-2H3
(3)InChIKey: UGZGMKGTJRTCFV-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C8H9BrO2/c1-5-3-6(9)4-7(11-2)8(5)10/h3-4,10H,1-2H3
(5)Std. InChIKey: UGZGMKGTJRTCFV-UHFFFAOYSA-N