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Structure

1-Octanol, 6-methyl-,(6S)-

CAS
110453-78-6
Catalog Number
ACM110453786
Category
Other Products
Molecular Weight
144.25g/mol
Molecular Formula
C9H20O

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Specification

IUPAC Name
(6S)-6-methyloctan-1-ol
Canonical SMILES
CCC(C)CCCCCO
InChI
InChI=1S/C9H20O/c1-3-9(2)7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/t9-/m0/s1
InChI Key
WWRGKAMABZHMCN-VIFPVBQESA-N
Complexity
61.7
Covalently-Bonded Unit Count
1
Exact Mass
144.151415g/mol
Formal Charge
0
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
10
Monoisotopic Mass
144.151415g/mol
Rotatable Bond Count
6
XLogP3
3.2
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