-
Name
Pyrazolo[1,5-a]pyridin-2-ylmethanol
- EINECS
- CAS No. 76943-47-0
- Article Data8
- CAS DataBase
- Density 1.26 g/cm3
- Solubility
- Melting Point
- Formula C8H8N2O
- Boiling Point
- Molecular Weight 148.164
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Pyrazolo[1,5-alpha]pyridin-2-ylmethanol;
- PSA 37.53000
- LogP 0.82660
Pyrazolo[1,5-a]pyridin-2-ylmethanol Specification
The systematic name Pyrazolo[1,5-alpha]pyridin-2-ylmethanol of is pyrazolo[1,5-a]pyridin-2-ylmethanol. With the CAS registry number 76943-47-0, it is also named as Pyrazolo[1,5-a]pyridine-2-methanol. The product's molecular formula is C8H8N2O and its molecular weight is 148.16.
The other characteristics of Pyrazolo[1,5-alpha]pyridin-2-ylmethanol can be summarized as: (1)Nominal mass: 148; (2)Average mass: 148.1619; (3)Monoisotopic mass: 148.063663; (4)ACD/LogP: 0.49; (5)# of Rule of 5 Violations: 0; (6)ACD/LogD (pH 5.5): 0.49; (7)ACD/LogD (pH 7.4): 0.49; (8)ACD/BCF (pH 5.5): 1.39; (9)ACD/BCF (pH 7.4): 1.4; (10)ACD/KOC (pH 5.5): 44.15; (11)ACD/KOC (pH 7.4): 44.19; (12)H bond acceptors: 3; (13)H bond donors: 1; (14)Freely Rotating Bonds: 2; (15)Polar Surface Area: 37.53 Å2; (16)Index of Refraction: 1.64; (17)Molar Refractivity: 42.17 cm3; (18)Molar Volume: 116.9 cm3; (19)Polarizability: 16.71 ×10-24cm3; (20)Surface Tension: 51.3 dyne/cm; (21)Density: 1.26 g/cm3.
People can use the following data to convert to the molecule structure.
SMILES:OCc1cc2ccccn2n1
InChI:InChI=1/C8H8N2O/c11-6-7-5-8-3-1-2-4-10(8)9-7/h1-5,11H,6H2
InChIKey:RBJIKLOMRJZRTN-UHFFFAOYAR
Std. InChI:InChI=1S/C8H8N2O/c11-6-7-5-8-3-1-2-4-10(8)9-7/h1-5,11H,6H2
Std. InChIKey:RBJIKLOMRJZRTN-UHFFFAOYSA-N
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