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4-hydroxy-3-methyl-2-(prop-2-en-1-yl)cyclopent-2-en-1-one

4-hydroxy-3-methyl-2-(prop-2-en-1-yl)cyclopent-2-en-1-one

CAS: 29605-88-7

Formula: C9H12O2

SMILES: CC1=C(CC=C)C(=O)CC1O

IUPAC: 4-hydroxy-3-methyl-2-(prop-2-en-1-yl)cyclopent-2-en-1-one

InChI: InChI=1/C9H12O2/c1-3-4-7-6(2)8(10)5-9(7)11/h3,8,10H,1,4-5H2,2H3

Composition: C (71.03%), H (7.95%), O (21.02%)

Molar Mass: 152.193

Atom Count: 23

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 152.083729626
Formal Charge 0
FSP3 0.44
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KZYVOZABVXLALY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.99
Topological Polar Surface Area 37.3
Polarizability 16.79
Ring Count 1
Rotatable Bond Count 2

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95% <5 Days 29605-88-7 $19,656.00-$73,500.00$19,656.00$36,750.00$73,500.00
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