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Cas Database |
| Name |
4,5,6,7-Tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid |
EINECS | N/A |
| CAS No. | 307307-97-7 | Density | 1.454g/cm3 |
| PSA | 55.12000 | LogP | 0.91760 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H10N2O2 | Boiling Point | 376.713 °C at 760 mmHg |
| Molecular Weight | 166.18 | Flash Point | 181.63 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Pyrazolo[1,5-a]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-;4,5,6,7-Tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid(SALTDATA: FREE);4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxylic acid |
Article Data | 2 |
4,5,6,7-Tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid Specification
The 4,5,6,7-Tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid, with CAS registry number 307307-97-7, has the systematic name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid. Besides this, it is also called pyrazolo[1,5-a]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-.
Physical properties about this chemical are: (1)ACD/LogP: 1.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 4; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 55.12 Å2; (12)Index of Refraction: 1.676; (13)Molar Refractivity: 43.026 cm3; (14)Molar Volume: 114.315 cm3; (15)Polarizability: 17.057×10-24cm3; (16)Surface Tension: 60.522 dyne/cm; (17)Enthalpy of Vaporization: 65.867 kJ/mol; (18)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c1cnn2CCCCc12
(2)InChI: InChI=1/C8H10N2O2/c11-8(12)6-5-9-10-4-2-1-3-7(6)10/h5H,1-4H2,(H,11,12)
(3)InChIKey: VOAKNFVZEGNOKV-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H10N2O2/c11-8(12)6-5-9-10-4-2-1-3-7(6)10/h5H,1-4H2,(H,11,12)
(5)Std. InChIKey: VOAKNFVZEGNOKV-UHFFFAOYSA-N
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