5-methoxy-1H-indazole-3-carbonitrile

5-methoxy-1H-indazole-3-carbonitrile

CAS: 90322-88-6

Formula: C9H7N3O

SMILES: COC1=CC=C2NN=C(C#N)C2=C1

IUPAC: 5-methoxy-1H-indazole-3-carbonitrile

InChI: InChI=1S/C9H7N3O/c1-13-6-2-3-8-7(4-6)9(5-10)12-11-8/h2-4H,1H3,(H,11,12)

Composition: C (62.42%), H (4.07%), N (24.27%), O (9.24%)

Molar Mass: 173.175

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	173.058911857
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XXCNXBQYSICCPC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.89
Topological Polar Surface Area	61.7
Polarizability	19
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<2 Days	90322-88-6		$187.45-$7,912.00$187.45$258.75$401.35$687.70$2,297.70$7,912.00