2-methyl-5-oxopentan-2-yl acetate

2-methyl-5-oxopentan-2-yl acetate

CAS: 110086-93-6

Formula: C8H14O3

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

IUPAC: 2-methyl-5-oxopentan-2-yl acetate

InChI: InChI=1S/C8H14O3/c1-7(10)11-8(2,3)5-4-6-9/h6H,4-5H2,1-3H3

Composition: C (60.74%), H (8.92%), O (30.34%)

Molar Mass: 158.197

Atom Count: 25

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	158.094294311
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CCVZQYSFWDNPSH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.08
Topological Polar Surface Area	43.37
Polarizability	16.33
Ring Count	0
Rotatable Bond Count	5

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