4H,5H-naphtho(1,2-b)thiophene-2-carboxylic acid structure

4H,5H-naphtho(1,2-b)thiophene-2-carboxylic acid

4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid

Also Known As: 4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylic acid|4H,5H-naphtho[1,2-b]thiophene-2-carboxylic acid|Oprea1_350152|KS-00001SZ9|dihydronaphthobthiophenecarboxylicacid|Naphtho[1,2-b]thiophene-2-carboxylic acid, 4,5-dihydro-|12N-508S|US12427135, Code PD00589|4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid|W-8424|4,5-Dihydro-naphtho[1,2-b]thiophene-2-carboxylic acid|4.5-Dihydronaphtho[1.2-b]thiophen-2-carbonsaeure|4H,5H-naphtho(1,2-b)thiophene-2-carboxylic acid

CAS: 29440-91-3
Molecular Formula C13H10O2S
Molecular Weight 230.04015 g/mol
LogP 3.4
Topological Polar Surface Area 65.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 1
Exact Mass 230.04015
Monoisotopic Mass 230.04015
Heavy Atoms 16
Complexity 292.0

Chemical Identifiers

CAS Number 29440-91-3
SMILES C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)O
InChIKey IGBRCZHGFVMFCR-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (5 patents) Pharmaceutical Intermediates (2 patents)

Product Overview

4H,5H-naphtho(1,2-b)thiophene-2-carboxylic acid (CAS 29440-91-3), with molecular formula C13H10O2S and molecular weight 230.04015 g/mol. IUPAC: 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid.

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