Benzaldehyde, 2-bromo-5-fluoro-4-methyl- supplier

Name
2-BROMO-5-FLUORO-4-METHYL BENZALDEHYDE
EINECS
CAS No. 916792-21-7
Density 1.575 g/cm³
Solubility
Melting Point
Formula C₈H₆BrFO
Boiling Point 248.818 °C at 760 mmHg
Molecular Weight 217.037
Flash Point 104.282 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzaldehyde,2-bromo-5-fluoro-4-methyl-
PSA 17.07000
LogP 2.70910

Benzaldehyde, 2-bromo-5-fluoro-4-methyl- Specification

This chemical is called Benzaldehyde, 2-bromo-5-fluoro-4-methyl-, and its systematic name is 2-bromo-5-fluoro-4-methyl-benzaldehyde. With the molecular formula of C₈H₆BrFO, its molecular weight is 217.04. The CAS registry number of this chemical is 916792-21-7.

Other characteristics of the Benzaldehyde, 2-bromo-5-fluoro-4-methyl- can be summarised as followings: (1)ACD/LogP: 2.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.522; (4)ACD/LogD (pH 7.4): 2.522; (5)ACD/BCF (pH 5.5): 48.604; (6)ACD/BCF (pH 7.4): 48.604; (7)ACD/KOC (pH 5.5): 560.962; (8)ACD/KOC (pH 7.4): 560.962; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.575; (14)Molar Refractivity: 45.515 cm³; (15)Molar Volume: 137.769 cm³; (16)Polarizability: 18.043×10^-24cm³; (17)Surface Tension: 40.522 dyne/cm; (18)Density: 1.575 g/cm³; (19)Flash Point: 104.282 °C; (20)Enthalpy of Vaporization: 48.603 kJ/mol; (21)Boiling Point: 248.818 °C at 760 mmHg; (22)Vapour Pressure: 0.024 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Cc1cc(c(cc1F)C=O)Br
2.InChI: InChI=1/C8H6BrFO/c1-5-2-7(9)6(4-11)3-8(5)10/h2-4H,1H3
3.InChIKey: RKDXMZSJZPGBRQ-UHFFFAOYAI

Product Name

2-BROMO-5-FLUORO-4-METHYL BENZALDEHYDE

Benzaldehyde, 2-bromo-5-fluoro-4-methyl- Specification

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