3-hydroxy-1-(oxolan-2-yl)but-2-en-1-one

3-hydroxy-1-(oxolan-2-yl)but-2-en-1-one

CAS: 860705-06-2

Formula: C8H12O3

SMILES: CC(O)=CC(=O)C1CCCO1

IUPAC: 3-hydroxy-1-(oxolan-2-yl)but-2-en-1-one

InChI: InChI=1/C8H12O3/c1-6(9)5-7(10)8-3-2-4-11-8/h5,8-9H,2-4H2,1H3

Composition: C (61.52%), H (7.74%), O (30.73%)

Molar Mass: 156.181

Atom Count: 23

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	156.078644246
Formal Charge	0
FSP3	0.62
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZAQFXOXUDKJVRO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.38
Topological Polar Surface Area	46.53
Polarizability	15.91
Ring Count	1
Rotatable Bond Count	2

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