Benzoic acid,3,5-dibromo-2-nitro- supplier

Name
3,5-DIBROMO-2-NITRO-BENZOIC ACID
EINECS
CAS No. 60912-52-9
Article Data4
CAS DataBase
Density 2.222 g/cm³
Solubility
Melting Point
Formula C₇H₃Br₂NO₄
Boiling Point 384.3 °C at 760 mmHg
Molecular Weight 324.91
Flash Point 186.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3,5-Dibromo-2-nitrobenzoic acid;
PSA 83.12000
LogP 3.34120

Benzoic acid,3,5-dibromo-2-nitro- Specification

The Benzoic acid,3,5-dibromo-2-nitro- has the CAS registry number 60912-52-9. This chemical's molecular formula is C₇H₃Br₂NO₄ and molecular weight is 324.91. What's more, its systematic name is 3,5-Dibromo-2-nitrobenzoic acid.

Physical properties of Benzoic acid,3,5-dibromo-2-nitro- are: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 83.12 Å²; (11)Index of Refraction: 1.677; (12)Molar Refractivity: 55.1 cm³; (13)Molar Volume: 146.1 cm³; (14)Polarizability: 21.84×10^-24cm³; (15)Surface Tension: 72 dyne/cm; (16)Density: 2.222 g/cm³; (17)Flash Point: 186.2 °C; (18)Enthalpy of Vaporization: 66.77 kJ/mol; (19)Boiling Point: 384.3 °C at 760 mmHg; (20)Vapour Pressure: 1.36E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=N(=O)c1c(cc(Br)cc1Br)C(O)=O
(2)InChI: InChI=1S/C7H3Br2NO4/c8-3-1-4(7(11)12)6(10(13)14)5(9)2-3/h1-2H,(H,11,12)
(3)InChIKey: OMBRWZUUZWYLAP-UHFFFAOYSA-N

Product Name

3,5-DIBROMO-2-NITRO-BENZOIC ACID

Benzoic acid,3,5-dibromo-2-nitro- Specification

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