4-phenylthiophene-2-carboxylic acid

4-phenylthiophene-2-carboxylic acid

CAS: 21676-88-0

Formula: C11H8O2S

SMILES: OC(=O)C1=CC(=CS1)C1=CC=CC=C1

IUPAC: 4-phenylthiophene-2-carboxylic acid

InChI: InChI=1S/C11H8O2S/c12-11(13)10-6-9(7-14-10)8-4-2-1-3-5-8/h1-7H,(H,12,13)

Composition: C (64.69%), H (3.95%), O (15.67%), S (15.70%)

Molar Mass: 204.24

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	204.024500672
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DOAFBJFYWLESRS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.34
Topological Polar Surface Area	37.3
Polarizability	22.27
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	21676-88-0		$147.73-$1,309.00$147.73$334.73$1,309.00

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99%	<5 Days	21676-88-0		$15.13-$78.18$15.13$21.44$78.18