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5-(4-ethoxyphenyl)-3-hydroxycyclohex-2-en-1-one

5-(4-ethoxyphenyl)-3-hydroxycyclohex-2-en-1-one

CAS: 762243-28-7

Formula: C14H16O3

SMILES: CCOC1=CC=C(C=C1)C1CC(O)=CC(=O)C1

IUPAC: 5-(4-ethoxyphenyl)-3-hydroxycyclohex-2-en-1-one

InChI: InChI=1/C14H16O3/c1-2-17-14-5-3-10(4-6-14)11-7-12(15)9-13(16)8-11/h3-6,9,11,15H,2,7-8H2,1H3

Composition: C (72.39%), H (6.94%), O (20.66%)

Molar Mass: 232.279

Atom Count: 33

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 232.109944375
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey OVOWMCNUVMUOMG-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.24
Topological Polar Surface Area 46.53
Polarizability 25.45
Ring Count 2
Rotatable Bond Count 3

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