3-[4-(4-Hydroxybutoxy)phenyl]prop-2-enoic acid

HCID 70143545CAS 334001-50-2
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Basic information

Standard SMILES
O=C(O)C=Cc1ccc(OCCCCO)cc1
InChIKey
NXDILGARGPQYLL-UHFFFAOYSA-N
Molecular formula
C13H16O4
Average molar mass
236.26 g/mol
Monoisotopic mass
236.10485899

Names & identifiers

Preferred name
3-[4-(4-Hydroxybutoxy)phenyl]prop-2-enoic acid
IUPAC
3-[4-(4-hydroxybutoxy)phenyl]prop-2-enoic acid

Names & synonyms

3-[4-(4-HYDROXYBUTOXY)PHENYL]PROP-2-ENOIC ACID334001-50-2SCHEMBL7607106DTXSID60741700NXDILGARGPQYLL-UHFFFAOYSA-N4-(4-Hydroxybutyloxy)cinnamic Acid

Database identifiers

CAS
334001-50-2
PubChem CID
70143545
DTXSID
DTXSID60741700

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
66.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
17

Related reactions

1 records
New reaction record

Linked notes

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