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1009601-79-9 | Pyrazolo[1,5-a]pyridine-4-carboxylic acid, 7-methoxy-2-(1-methylethyl)-
CAS No: 1009601-79-9 Catalog No: AG0003B9 MDL No:
Product Description
Catalog Number:
AG0003B9
Chemical Name:
Pyrazolo[1,5-a]pyridine-4-carboxylic acid, 7-methoxy-2-(1-methylethyl)-
CAS Number:
1009601-79-9
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
IUPAC Name:
7-methoxy-2-propan-2-ylpyrazolo[1,5-a]pyridine-4-carboxylic acid
InChI:
InChI=1S/C12H14N2O3/c1-7(2)9-6-10-8(12(15)16)4-5-11(17-3)14(10)13-9/h4-7H,1-3H3,(H,15,16)
InChI Key:
PPOLRTCKWXWFDN-UHFFFAOYSA-N
SMILES:
COc1ccc(c2n1nc(c2)C(C)C)C(=O)O
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.255g/mol
Monoisotopic Mass:
234.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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