4H,5H,6H-cyclopenta[b]thiophene-2-carboxylic acid

4H,5H,6H-cyclopenta[b]thiophene-2-carboxylic acid

CAS: 40133-06-0

Formula: C8H8O2S

SMILES: OC(=O)C1=CC2=C(CCC2)S1

IUPAC: 4H,5H,6H-cyclopenta[b]thiophene-2-carboxylic acid

InChI: InChI=1S/C8H8O2S/c9-8(10)7-4-5-2-1-3-6(5)11-7/h4H,1-3H2,(H,9,10)

Composition: C (57.12%), H (4.79%), O (19.02%), S (19.06%)

Molar Mass: 168.21

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	168.024500672
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XSFUFVBXPLWNBK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.02
Topological Polar Surface Area	37.3
Polarizability	16.02
Ring Count	2
Rotatable Bond Count	1

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