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Benzenemethanamine,2,3-difluoro-4-methyl-

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Name

Benzenemethanamine,2,3-difluoro-4-methyl-

EINECS N/A
CAS No. 261763-41-1 Density 1.171 g/cm3
PSA 26.02000 LogP 2.43220
Solubility N/A Melting Point N/A
Formula C8H9F2N Boiling Point 201.6 °C at 760 mmHg
Molecular Weight 157.1605664 Flash Point 93.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 261763-41-1 (Benzenemethanamine, 2,3-difluoro-4-methyl- (9CI)) Hazard Symbols N/A
Synonyms

2,3-Difluoro-4-methylbenzylamine;Benzenemethanamine, 2,3-difluoro-4-methyl- (9CI);

 

Benzenemethanamine,2,3-difluoro-4-methyl- Specification

The CAS register number of Benzenemethanamine,2,3-difluoro-4-methyl- is 261763-41-1. It also can be called as 2,3-Difluoro-4-methylbenzylamine and the IUPAC name about this chemical is (2,3-difluoro-4-methylphenyl)methanamine. The molecular formula about this chemical is C8H9F2N and the molecular weight is 157.1605664. It belongs to the following product category which includes Halide.

Physical properties about Benzenemethanamine,2,3-difluoro-4-methyl- are: (1)ACD/LogP: 1.56; (2)ACD/LogD (pH 5.5): -1.33; (3)ACD/LogD (pH 7.4): 0.14; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 6.36; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.501; (13)Molar Refractivity: 39.51 cm3; (14)Molar Volume: 134.1 cm3; (15)Polarizability: 15.66x10-24cm3; (16)Surface Tension: 34.4 dyne/cm; (17)Density: 1.171 g/cm3; (18)Flash Point: 93.9 °C; (19)Enthalpy of Vaporization: 43.79 kJ/mol; (20)Boiling Point: 201.6 °C at 760 mmHg; (21)Vapour Pressure: 0.305 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(ccc(c1F)CN)C
(2)InChI: InChI=1/C8H9F2N/c1-5-2-3-6(4-11)8(10)7(5)9/h2-3H,4,11H2,1H3
(3)InChIKey: BHMZMUKPFBBPKG-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H9F2N/c1-5-2-3-6(4-11)8(10)7(5)9/h2-3H,4,11H2,1H3
(5)Std. InChIKey: BHMZMUKPFBBPKG-UHFFFAOYSA-N

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