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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 | Hazard Symbols | N/A | |
Synonyms |
2,3-Difluoro-4-methylbenzylamine;Benzenemethanamine, 2,3-difluoro-4-methyl- (9CI); |
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