1-(5-Chloromethylthiophen-2-yl)-cyclopent-3-ene carboxylic acid ethyl ester

HCID 54533137
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Basic information

Standard SMILES
CCOC(=O)C1(c2ccc(CCl)s2)CC=CC1
InChIKey
YXXSTRCVAQPDJV-UHFFFAOYSA-N
Molecular formula
C13H15ClO2S
Average molar mass
270.78 g/mol

Names & identifiers

Preferred name
1-(5-Chloromethylthiophen-2-yl)-cyclopent-3-ene carboxylic acid ethyl ester
IUPAC
ethyl 1-[5-(chloromethyl)thiophen-2-yl]cyclopent-3-ene-1-carboxylate

Names & synonyms

SCHEMBL244149YXXSTRCVAQPDJV-UHFFFAOYSA-N1-(5-chloromethylthiophen-2-yl)-cyclopent-3-ene carboxylic acid ethyl ester

Database identifiers

PubChem CID
54533137

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
54.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
17

Related reactions

4 records
New reaction record

Compound notes

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