CAS No.239087-07-1,2-fluoro-4-(trifluoromethyl)benzyl bromide Suppliers

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Basic Information

Molecular Structure:
CAS No.:	239087-07-1
Name:	2-fluoro-4-(trifluoromethyl)benzyl bromide

Formula:	C₈H₅BrF₄
Molecular Weight:	257.0229128
Synonyms:	1-(Bromomethyl)-2-fluoro-4-(trifluoromethyl)benzene;2-Fluoro-4-trifluoromethylbenzyl bromide;
Density:	1.64 g/cm³
Melting Point:	28-30 °C
Boiling Point:	197.1 °C at 760 mmHg
Flash Point:	94.7 °C
Hazard Symbols:	C,Xi
Risk Codes:	34-36/37/38
Safety:	26-36/37/39
PSA:	0.00000
LogP:	3.73940

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Specification

The Benzene,1-(bromomethyl)-2-fluoro-4-(trifluoromethyl)- is an organic compound with the formula C₈H₅BrF₄. The IUPAC name of this chemical is 1-(bromomethyl)-2-fluoro-4-(trifluoromethyl)benzene. With the CAS registry number 239087-07-1, it is also named as 2-Fluoro-4-(trifluoromethyl)benzyl bromide.

Physical properties about Benzene,1-(bromomethyl)-2-fluoro-4-(trifluoromethyl)- are: (1)ACD/LogP: 3.38; (2)ACD/LogD (pH 5.5): 3.38; (3)ACD/LogD (pH 7.4): 3.38; (4)ACD/BCF (pH 5.5): 219.41; (5)ACD/BCF (pH 7.4): 219.41; (6)ACD/KOC (pH 5.5): 1649.97; (7)ACD/KOC (pH 7.4): 1649.97; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.472; (10)Molar Refractivity: 43.87 cm³; (11)Molar Volume: 156.6 cm³; (12)Polarizability: 17.39×10^-24cm³; (13)Surface Tension: 28 dyne/cm; (14)Density: 1.64 g/cm³; (15)Flash Point: 94.7 °C; (16)Enthalpy of Vaporization: 41.56 kJ/mol; (17)Boiling Point: 197.1 °C at 760 mmHg; (18)Vapour Pressure: 0.542 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It can cause burns. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCc1ccc(cc1F)C(F)(F)F
(2)InChI: InChI=1/C8H5BrF4/c9-4-5-1-2-6(3-7(5)10)8(11,12)13/h1-3H,4H2
(3)InChIKey: MQUCRCQNRDHRPL-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C8H5BrF4/c9-4-5-1-2-6(3-7(5)10)8(11,12)13/h1-3H,4H2
(5)Std. InChIKey: MQUCRCQNRDHRPL-UHFFFAOYSA-N