2,2,4,4-tetramethylpentan-3-one

2,2,4,4-tetramethylpentan-3-one

CAS: 815-24-7

Formula: C9H18O

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

IUPAC: 2,2,4,4-tetramethylpentan-3-one

InChI: InChI=1S/C9H18O/c1-8(2,3)7(10)9(4,5)6/h1-6H3

Composition: C (76.00%), H (12.76%), O (11.25%)

Molar Mass: 142.242

Atom Count: 28

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	142.1357652
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	UIQGEWJEWJMQSL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.6
Topological Polar Surface Area	17.07
Polarizability	17.39
Ring Count	0
Rotatable Bond Count	2

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