2H,4H,5H-furo[2,3-c]pyrazole-3-carboxylic acid

2H,4H,5H-furo[2,3-c]pyrazole-3-carboxylic acid

CAS: 595610-49-4

Formula: C6H6N2O3

SMILES: OC(=O)C1=C2CCOC2=NN1

IUPAC: 2H,4H,5H-furo[2,3-c]pyrazole-3-carboxylic acid

InChI: InChI=1S/C6H6N2O3/c9-6(10)4-3-1-2-11-5(3)8-7-4/h1-2H2,(H,7,8)(H,9,10)

Composition: C (46.76%), H (3.92%), N (18.18%), O (31.14%)

Molar Mass: 154.125

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	154.037842061
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	YCRWSEXDMMDFIS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.97
Topological Polar Surface Area	75.21
Polarizability	13.21
Ring Count	2
Rotatable Bond Count	1

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