CAS No.359-25-1,BROMOFLUOROACETIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	359-25-1
Name:	BROMOFLUOROACETIC ACID
Article Data:	8

Formula:	C₂H₂BrFO₂
Molecular Weight:	156.939
Synonyms:	Bromofluoroacetic acid;Bromo(fluoro)acetic acid;
Density:	2.087 g/cm³
Melting Point:	50°C
Boiling Point:	183 °C at 760 mmHg
Flash Point:	67.5 °C
Safety:	24/25
PSA:	37.30000
LogP:	0.76150

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Specification

The Acetic acid,2-bromo-2-fluoro-, with the CAS registry number 359-25-1, is also known as Bromofluoroacetic acid. This chemical's molecular formula is C₂H₂BrFO₂ and molecular weight is 156.94. What's more, its systematic name is Bromo(fluoro)acetic acid.

Physical properties of Acetic acid,2-bromo-2-fluoro- are: (1)ACD/LogP: 0.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.53; (4)ACD/LogD (pH 7.4): -2.8; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.463; (14)Molar Refractivity: 20.73 cm³; (15)Molar Volume: 75.1 cm³; (16)Polarizability: 8.21×10^-24 cm³; (17)Surface Tension: 43 dyne/cm; (18)Density: 2.087 g/cm³; (19)Flash Point: 67.5 °C; (20)Enthalpy of Vaporization: 46.22 kJ/mol; (21)Boiling Point: 183 °C at 760 mmHg; (22)Vapour Pressure: 0.362 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrC(F)C(=O)O
(2)InChI: InChI=1/C2H2BrFO2/c3-1(4)2(5)6/h1H,(H,5,6)
(3)InChIKey: ICTXGKNZADORBH-UHFFFAOYAD