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3-hydroxyhexane-2,5-dione

3-hydroxyhexane-2,5-dione

Formula: C6H10O3

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

IUPAC: 3-hydroxyhexane-2,5-dione

InChI: InChI=1/C6H10O3/c1-4(7)3-6(9)5(2)8/h6,9H,3H2,1-2H3

Composition: C (55.37%), H (7.75%), O (36.88%)

Molar Mass: 130.143

Atom Count: 19

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 130.062994182
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey MXGSILCFPNVDMX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 31.98
Topological Polar Surface Area 54.37
Polarizability 12.61
Ring Count 0
Rotatable Bond Count 3

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C6H10O3 Quote Only