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4,4-dimethylhexan-1-ol

4,4-dimethylhexan-1-ol

CAS: 6481-95-4

Formula: C8H18O

SMILES: CCC(C)(C)CCCO

IUPAC: 4,4-dimethylhexan-1-ol

InChI: InChI=1S/C8H18O/c1-4-8(2,3)6-5-7-9/h9H,4-7H2,1-3H3

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 0
Exact Mass 130.1357652
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey VZWIUKUDEGQHIO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.36
Topological Polar Surface Area 20.23
Polarizability 16.09
Ring Count 0
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 6481-95-4 $4,290.00-$9,072.00$4,290.00$5,670.00$9,072.00
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