3-(3,4-Difluorophenyl)prop-2-enoic acid

HCID 145486
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Basic information

Standard SMILES
O=C(O)C=Cc1ccc(F)c(F)c1
InChIKey
HXBOHZQZTWAEHJ-UHFFFAOYSA-N
Molecular formula
C9H6F2O2
Average molar mass
184.14 g/mol
Monoisotopic mass
184.03358575

Names & identifiers

Preferred name
3-(3,4-Difluorophenyl)prop-2-enoic acid
IUPAC
3-(3,4-difluorophenyl)prop-2-enoic acid

Names & synonyms

3-(3,4-difluorophenyl)prop-2-enoic acid152152-17-52-Propenoic acid,3-(3,4-difluorophenyl)-2-Propenoic acid, 3-(3,4-difluorophenyl)-3,4-difluoro-cinnamic acid3,4-di-fluoro-cinnamic acidSCHEMBL407485HXBOHZQZTWAEHJ-UHFFFAOYSA-N(2E)-3-(3,4-Difluorophenyl)Acrylic AcidDB-041131NS00015741

Database identifiers

PubChem CID
145486

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
13

Related reactions

22 records
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Linked notes

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