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4-hydroxy-2-(hydroxymethyl)cyclopent-2-en-1-one

4-hydroxy-2-(hydroxymethyl)cyclopent-2-en-1-one

CAS: 76374-26-0

Formula: C6H8O3

SMILES: OCC1=CC(O)CC1=O

IUPAC: 4-hydroxy-2-(hydroxymethyl)cyclopent-2-en-1-one

InChI: InChI=1/C6H8O3/c7-3-4-1-5(8)2-6(4)9/h1,5,7-8H,2-3H2

Composition: C (56.25%), H (6.29%), O (37.46%)

Molar Mass: 128.127

Atom Count: 17

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 128.047344118
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey SAXYYSFDXQHLOD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 32.23
Topological Polar Surface Area 57.53
Polarizability 12.19
Ring Count 1
Rotatable Bond Count 1

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