4-Bromo-2-fluoro-5-nitrobenzoic acid supplier

Name
BENZOIC ACID, 4-BROMO-2-FLUORO-5-NITRO-
EINECS
CAS No. 355423-16-4
Density 1.967 g/cm³
Solubility
Melting Point
Formula C₇H₃BrFNO₄
Boiling Point 334.044 °C at 760 mmHg
Molecular Weight 264.01
Flash Point 155.824 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-2-fluoro-5-nitrobenzoic acid;
PSA 83.12000
LogP 2.71780

4-Bromo-2-fluoro-5-nitrobenzoic acid Specification

The Benzoicacid, 4-bromo-2-fluoro-5-nitro- has the CAS registry number 355423-16-4. This chemical's molecular formula is C₇H₃BrFNO₄ and molecular weight is 264.01. What's more, its systematic name is 4-Bromo-2-fluoro-5-nitrobenzoic acid.

Physical properties of Benzoicacid, 4-bromo-2-fluoro-5-nitro- are: (1)ACD/LogP: 2.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): -1; (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: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 83.12 Å²; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 47.412 cm³; (15)Molar Volume: 134.199 cm³; (16)Polarizability: 18.796×10^-24cm³; (17)Surface Tension: 66.001 dyne/cm; (18)Density: 1.967 g/cm³; (19)Flash Point: 155.824 °C; (20)Enthalpy of Vaporization: 60.9 kJ/mol; (21)Boiling Point: 334.044 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cc(c(F)cc1Br)C(=O)O
(2)InChI: InChI=1/C7H3BrFNO4/c8-4-2-5(9)3(7(11)12)1-6(4)10(13)14/h1-2H,(H,11,12)
(3)InChIKey: OGSIBDAVDNXXMS-UHFFFAOYSA-N

Product Name

BENZOIC ACID, 4-BROMO-2-FLUORO-5-NITRO-

4-Bromo-2-fluoro-5-nitrobenzoic acid Specification

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