1-oxo-2,3-dihydroindene-5-carboxylic acid

1-oxo-2,3-dihydroindene-5-carboxylic acid

CAS: 3470-45-9

Formula: C10H8O3

SMILES: OC(=O)C1=CC=C2C(=O)CCC2=C1

IUPAC: 1-oxo-2,3-dihydro-1H-indene-5-carboxylic acid

InChI: InChI=1S/C10H8O3/c11-9-4-2-6-5-7(10(12)13)1-3-8(6)9/h1,3,5H,2,4H2,(H,12,13)

Composition: C (68.18%), H (4.58%), O (27.24%)

Molar Mass: 176.171

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	176.047344118
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SLLCLJRVOCBDTC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.98
Topological Polar Surface Area	54.37
Polarizability	17.52
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97.21%	<7 Days	3470-45-9		$43.95-$1,050.01$43.95$61.71$222.53$618.04$1,050.01