3-(1-hydroxy-ethyl)-5,6-dihydro-4H-cyclopenta[c]thiophene-1-carboxylic acid methyl ester

HCID 71014121

Basic information

Standard SMILES
COC(=O)c1sc(C(C)O)c2c1CCC2
InChIKey
CCYDXLCXUPOUTN-UHFFFAOYSA-N
Molecular formula
C11H14O3S
Average molar mass
226.29 g/mol

Names & identifiers

Preferred name
3-(1-hydroxy-ethyl)-5,6-dihydro-4H-cyclopenta[c]thiophene-1-carboxylic acid methyl ester
IUPAC
methyl 1-(1-hydroxyethyl)-5,6-dihydro-4H-cyclopenta[c]thiophene-3-carboxylate

Names & synonyms

SCHEMBL13857963CCYDXLCXUPOUTN-UHFFFAOYSA-NDB-3866933-(1-hydroxy-ethyl)-5,6-dihydro-4H-cyclopenta[c]thiophene-1-carboxylic acid methyl esterMethyl 5,6-dihydro-3-(1-hydroxyethyl)-4H-cyclopenta[c]thiophene-1-carboxylate1414642-78-6

Database identifiers

PubChem CID
71014121

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
74.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
15

Related reactions

6 records

Compound notes

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