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1-cyclopentyl-3-hydroxybut-2-en-1-one

1-cyclopentyl-3-hydroxybut-2-en-1-one

Formula: C9H14O2

SMILES: CC(O)=CC(=O)C1CCCC1

IUPAC: 1-cyclopentyl-3-hydroxybut-2-en-1-one

InChI: InChI=1S/C9H14O2/c1-7(10)6-9(11)8-4-2-3-5-8/h6,8,10H,2-5H2,1H3

Composition: C (70.10%), H (9.15%), O (20.75%)

Molar Mass: 154.209

Atom Count: 25

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 154.099379691
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NPESVZJGMQWARE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.24
Topological Polar Surface Area 37.3
Polarizability 17.03
Ring Count 1
Rotatable Bond Count 2

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C9H14O2 Quote Only