3-Bromo-4-chloroanisole supplier

Name
3-BROMO-4-CHLOROANISOLE
EINECS
CAS No. 2732-80-1
Article Data3
CAS DataBase
Density 1.564 g/cm³
Solubility
Melting Point 179-180℃
Formula C₇H₆BrClO
Boiling Point 231.9 °C at 760 mmHg
Molecular Weight 221.481
Flash Point 94.1 °C
Transport Information
Appearance
Safety
Risk Codes 22-51
Molecular Structure
Hazard Symbols Xi
Synonyms Anisole,3-bromo-4-chloro- (7CI,8CI);1-Bromo-2-chloro-5-methoxybenzene;2-Bromo-1-chloro-4-methoxybenzene;
PSA 9.23000
LogP 3.11110

3-Bromo-4-chloroanisole Specification

The Benzene,2-bromo-1-chloro-4-methoxy-, with the CAS registry number 2732-80-1, is also known as 3-Bromo-4-chloroanisole. It belongs to the product categories of Aromatic Ethers; Anisoles, Alkyloxy Compounds & Phenylacetates; Bromine Compounds; Chlorine Compounds. This chemical's molecular formula is C₇H₆BrClO and formula weight is 221.48. What's more, its IUPAC name is 2-bromo-1-chloro-4-methoxybenzene.

Physical properties of Benzene,2-bromo-1-chloro-4-methoxy- are: (1)ACD/LogP: 3.62; (2)ACD/LogD (pH 5.5): 3.62; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Index of Refraction: 1.556; (7)Molar Refractivity: 45.51 cm³; (8)Molar Volume: 141.5 cm³; (9)Surface Tension: 37.4 dyne/cm; (10)Density: 1.564 g/cm³; (11)Flash Point: 101.6 °C; (12)Enthalpy of Vaporization: 46.19 kJ/mol; (13)Boiling Point: 244.3 °C at 760 mmHg; (14)Vapour Pressure: 0.0477 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC(=C(C=C1)Cl)Br
(2)InChI: InChI=1S/C7H6BrClO/c1-10-5-2-3-7(9)6(8)4-5/h2-4H,1H3
(3)InChIKey: SQHMXVXKKCXIGN-UHFFFAOYSA-N

Product Name

3-BROMO-4-CHLOROANISOLE

3-Bromo-4-chloroanisole Specification

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