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| CAS No.: | 1052708-46-9 |
|---|---|
| Name: | 3-aMino-6-broMo-2-pyridinecarboxylic acid |
| Article Data: | 4 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C6H5BrN2O2 |
| Molecular Weight: | 217.022 |
| Synonyms: | 3-Amino-6-bromopyridine-2-carboxylic acid; |
| Density: | 1.91 g/cm3 |
| Boiling Point: | 412.215 °C at 760 mmHg |
| Flash Point: | 203.101 °C |
| PSA: | 76.21000 |
| LogP: | 1.70570 |
- 10527-11-41H-Inden-5-ol,2,3-dihydro-3-(4-hydroxyphenyl)-1,1,3-trimethyl-
- 1052713-41-31-Piperidinecarboxylic acid, 4-fluoro-3-hydroxy-, phenylmethyl ester, (3R,4R)-rel-
- 1052714-46-16-Bromo-5-fluoro-2-pyridinecarboxylic acid
- 1052714-68-73-Aminopyridine-4-boronic acid pinacol ester
- 105-28-21H-Imidazole,2-heptadecyl-4,5-dihydro-
- 10528-65-12-Pentanone,4-methyl-4-(4-methylphenyl)-
- 105300-90-1Benzenebutanoic acid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-
- 105-30-61-Pentanol, 2-methyl-
- 105310-47-2Cyclopropanecarboxamide,2-(aminomethyl)-N,N-diethyl-1-phenyl-, monohydrochloride, (1R,2R)-rel- (9CI)
- 105310-75-6Cyclopropanecarboxamide,2-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]-N,N-diethyl-1-phenyl-,(1R,2S)-rel-
- Total:21 Page 1 of 1 1
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Specification
The 3-Amino-6-bromo-2-pyridinecarboxylic acid, with the CAS registry number 1052708-46-9, is also known as 3-Amino-6-bromopicolinic acid. This chemical's molecular formula is C6H5BrN2O2 and molecular weight is 217.02. What's more, its IUPAC name is called 3-Amino-6-bromopyridine-2-carboxylic acid.
Physical properties about 3-Amino-6-bromo-2-pyridinecarboxylic acid are: (1)ACD/LogP: 0.947; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.94; (4)ACD/LogD (pH 7.4): -2.12; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.01; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 76.21 Å2; (13)Index of Refraction: 1.685; (14)Molar Refractivity: 43.2 cm3; (15)Molar Volume: 113.652 cm3; (16)Polarizability: 17.126×10-24cm3; (17)Surface Tension: 79.982 dyne/cm; (18)Density: 1.91 g/cm3; (19)Flash Point: 203.101 °C; (20)Enthalpy of Vaporization: 70.096 kJ/mol; (21)Boiling Point: 412.215 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(nc(c1N)C(=O)O)Br
(2) InChI: InChI=1S/C6H5BrN2O2/c7-4-2-1-3(8)5(9-4)6(10)11/h1-2H,8H2,(H,10,11)
(3) InChIKey: HXBNYDVCPBSMTF-UHFFFAOYSA-N