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CRDB_AN000006

PubChem Compound ID CID10130870
CRDB ID CRDB_AN000006
Molecular Formula C14H18O3
IUPAC Name (E)-1-(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
IUPAC CAS Name (E)-1-(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one
IUPAC Traditional Name (E)-1-(4-hydroxy-3-methoxy-phenyl)hept-4-en-3-one
Common Name NA
SMILES CCC=CC(=O)CCC1=CC(=C(C=C1)O)OC
2D Structure
Molecular Weight 234.29092
Exact Mass 234.125594
TPSA 46.5
XLOGP3_AA
H-Bond Donor 1
H-Bond Acceptor 3
Rotatable Bond 6
Heavy Atom Count 17
Tautomer Count 15
Total Charge 0
Author 0
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