3-Bromo-5-chloroanisole supplier

Name
1-BROMO-3-CHLORO-5-METHOXYBENZENE
EINECS
CAS No. 174913-12-3
Article Data3
CAS DataBase
Density 1.564 g/cm³
Solubility
Melting Point
Formula C₇H₆BrClO
Boiling Point 236.473 °C at 760 mmHg
Molecular Weight 221.481
Flash Point 96.816 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Bromo-3-chloro-5-methoxybenzene;
PSA 9.23000
LogP 3.11110

3-Bromo-5-chloroanisole Specification

This chemical is called 3-Bromo-5-chloroanisole, and its systematic name is 1-Bromo-3-chloro-5-methoxybenzene. With the molecular formula of C₇H₆BrClO, its molecular weight is 221.48. The CAS registry number of this chemical is 174913-12-3. Additionally, it should be stored at room temperature.

Other characteristics of the 3-Bromo-5-chloroanisole can be summarised as followings: (1)ACD/LogP: 3.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 457; (6)ACD/BCF (pH 7.4): 457; (7)ACD/KOC (pH 5.5): 2789; (8)ACD/KOC (pH 7.4): 2789; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.556; (14)Molar Refractivity: 45.517 cm³; (15)Molar Volume: 141.571 cm³; (16)Polarizability: 18.044×10^-24cm³; (17)Surface Tension: 37.489 dyne/cm; (18)Density: 1.564 g/cm³; (19)Flash Point: 96.816 °C; (20)Enthalpy of Vaporization: 45.407 kJ/mol; (21)Boiling Point: 236.473 °C at 760 mmHg; (22)Vapour Pressure: 0.073 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Clc1cc(OC)cc(Br)c1
2.InChI: InChI=1/C7H6BrClO/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3
3.InChIKey: VOGGSKPTKSAXHR-UHFFFAOYAN

Product Name

1-BROMO-3-CHLORO-5-METHOXYBENZENE

3-Bromo-5-chloroanisole Specification

Related Products

Hot Products