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1-(oxan-4-yl)propan-1-one

1-(oxan-4-yl)propan-1-one

CAS: 7464-18-8

Formula: C8H14O2

SMILES: CCC(=O)C1CCOCC1

IUPAC: 1-(oxan-4-yl)propan-1-one

InChI: InChI=1S/C8H14O2/c1-2-8(9)7-3-5-10-6-4-7/h7H,2-6H2,1H3

Composition: C (67.57%), H (9.92%), O (22.50%)

Molar Mass: 142.198

Atom Count: 24

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 142.099379691
Formal Charge 0
FSP3 0.87
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey JTOHKFHWPJJISH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.57
Topological Polar Surface Area 26.3
Polarizability 15.5
Ring Count 1
Rotatable Bond Count 2

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