2,5-Dibromonicotinic acid supplier

Name
2,5-DIBROMONICOTINIC ACID
EINECS
CAS No. 29312-99-0
Density 2.202 g/cm³
Solubility
Melting Point 184 °C
Formula C₆H₃Br₂NO₂
Boiling Point 367.1 °C at 760 mmHg
Molecular Weight 280.903
Flash Point 175.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Nicotinicacid, 2,5-dibromo- (8CI);2,5-Dibromonicotinic acid;
PSA 50.19000
LogP 2.30480

2,5-Dibromonicotinic acid Specification

This chemical is called 2,5-Dibromonicotinic acid, and its systematic name is 2,5-dibromopyridine-3-carboxylic acid. With the molecular formula of C₆H₃Br₂NO₂, its molecular weight is 280.90. The CAS registry number of this chemical is 29312-99-0.

Other characteristics of the 2,5-Dibromonicotinic acid can be summarised as followings: (1)ACD/LogP: 1.53; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.52; (4)ACD/LogD (pH 7.4): -1.62; (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: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 39.19 Å²; (13)Index of Refraction: 1.652; (14)Molar Refractivity: 46.65 cm³; (15)Molar Volume: 127.5 cm³; (16)Polarizability: 18.49×10^-24cm³; (17)Surface Tension: 66.7 dyne/cm; (18)Density: 2.202 g/cm³; (19)Flash Point: 175.8 °C; (20)Enthalpy of Vaporization: 64.74 kJ/mol; (21)Boiling Point: 367.1 °C at 760 mmHg; (22)Vapour Pressure: 4.9E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(Br)cnc1Br
(2)InChI: InChI=1/C6H3Br2NO2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2H,(H,10,11)
(3)InChIKey: BRPWRSWAXHWEPS-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C6H3Br2NO2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2H,(H,10,11)
(5)Std. InChIKey: BRPWRSWAXHWEPS-UHFFFAOYSA-N

Product Name

2,5-DIBROMONICOTINIC ACID

2,5-Dibromonicotinic acid Specification

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