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7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid

7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid

CAS: 1016505-59-1

Formula: C8H7N3O2

SMILES: CC1=CC=NC2=C(C=NN12)C(O)=O

IUPAC: 7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid

InChI: InChI=1S/C8H7N3O2/c1-5-2-3-9-7-6(8(12)13)4-10-11(5)7/h2-4H,1H3,(H,12,13)

Composition: C (54.24%), H (3.98%), N (23.72%), O (18.06%)

Molar Mass: 177.163

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 177.053826477
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey ZDHMVXYJWKLOQS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.18
Topological Polar Surface Area 67.49
Polarizability 16.57
Ring Count 2
Rotatable Bond Count 1

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