4-(2-Thienylmethoxymethyl)-2-(2-methylphenyl)benzoic acid

HCID 22014336
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Basic information

Standard SMILES
Cc1ccccc1-c1cc(COCc2cccs2)ccc1C(=O)O
InChIKey
NEGZFHFIDFNUFX-UHFFFAOYSA-N
Molecular formula
C20H18O3S
Average molar mass
338.4 g/mol

Names & identifiers

Preferred name
4-(2-Thienylmethoxymethyl)-2-(2-methylphenyl)benzoic acid
IUPAC
2-(2-methylphenyl)-4-(thiophen-2-ylmethoxymethyl)benzoic acid

Names & synonyms

SCHEMBL7904841NEGZFHFIDFNUFX-UHFFFAOYSA-N4-(2-thienylmethoxymethyl)-2-(2-methylphenyl)benzoic acid

Database identifiers

PubChem CID
22014336

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
74.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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