2,4,4-trimethylpentan-1-ol

2,4,4-trimethylpentan-1-ol

CAS: 16325-63-6

Formula: C8H18O

SMILES: CC(CO)CC(C)(C)C

IUPAC: 2,4,4-trimethylpentan-1-ol

InChI: InChI=1/C8H18O/c1-7(6-9)5-8(2,3)4/h7,9H,5-6H2,1-4H3

Composition: C (73.78%), H (13.93%), O (12.29%)

Molar Mass: 130.231

Atom Count: 27

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	130.1357652
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	ZNRVRWHPZZOTIE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.23
Topological Polar Surface Area	20.23
Polarizability	16.09
Ring Count	0
Rotatable Bond Count	3

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