5,6-dimethoxy-1H-indazole-3-carboxylic acid

5,6-dimethoxy-1H-indazole-3-carboxylic acid

CAS: 29281-07-0

Formula: C10H10N2O4

SMILES: COC1=C(OC)C=C2C(NN=C2C(O)=O)=C1

IUPAC: 5,6-dimethoxy-1H-indazole-3-carboxylic acid

InChI: InChI=1S/C10H10N2O4/c1-15-7-3-5-6(4-8(7)16-2)11-12-9(5)10(13)14/h3-4H,1-2H3,(H,11,12)(H,13,14)

Composition: C (54.05%), H (4.54%), N (12.61%), O (28.80%)

Molar Mass: 222.2

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	222.06405681
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	IWUGDDTXRWFNJY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.88
Topological Polar Surface Area	84.44
Polarizability	22.05
Ring Count	2
Rotatable Bond Count	3

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