Ccris 2231

HCID 92853CAS 959-23-9
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Basic information

Standard SMILES
COc1ccc(C(=O)C=Cc2ccccc2)cc1
InChIKey
KJHHAPASNNVTSN-UHFFFAOYSA-N
Molecular formula
C16H14O2
Average molar mass
238.28 g/mol
Monoisotopic mass
238.09937969

Names & identifiers

Preferred name
Ccris 2231
IUPAC
1-(4-methoxyphenyl)-3-phenylprop-2-en-1-one

Names & synonyms

NSC 37157CCRIS 22311-(4-Methoxy-phenyl)-3-phenyl-propenoneEINECS 213-495-5Spectrum_000480AI3-25493Spectrum2_000820Spectrum3_001191Spectrum4_001578UNII-BM45N45FIZCBDivE_001976KBioGR_002136
Show more names
KBioSS_000960SCHEMBL521905p-methoxybenzylideneacetophenoneSPBio_000719orb1220344KBio2_000960KBio2_003528KBio2_006096

Database identifiers

CAS
959-23-9
PubChem CID
92853
DTXSID
DTXSID401034535

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
18

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

Related reactions

5 records
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Linked notes

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