1-benzofuran-7-carboxylic acid

1-benzofuran-7-carboxylic acid

CAS: 90484-22-3

Formula: C9H6O3

SMILES: OC(=O)C1=C2OC=CC2=CC=C1

IUPAC: 1-benzofuran-7-carboxylic acid

InChI: InChI=1S/C9H6O3/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-5H,(H,10,11)

Composition: C (66.67%), H (3.73%), O (29.60%)

Molar Mass: 162.144

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	162.031694053
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QMHILIQFOBNARN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.16
Topological Polar Surface Area	50.44
Polarizability	17.03
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	90484-22-3		$52.96-$192.93$52.96$192.93