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86470-30-6 | 1-Decanol, 8-methyl-, (8S)-
CAS No: 86470-30-6 Catalog No: AG004QPT MDL No:
Product Description
Catalog Number:
AG004QPT
Chemical Name:
1-Decanol, 8-methyl-, (8S)-
CAS Number:
86470-30-6
Molecular Formula:
C11H24O
Molecular Weight:
172.3077
IUPAC Name:
(8S)-8-methyldecan-1-ol
InChI:
InChI=1S/C11H24O/c1-3-11(2)9-7-5-4-6-8-10-12/h11-12H,3-10H2,1-2H3/t11-/m0/s1
InChI Key:
SEBPZDSJYVVIEX-NSHDSACASA-N
SMILES:
OCCCCCCC[C@H](CC)C
Properties
Complexity:
81.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
172.183g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.312g/mol
Monoisotopic Mass:
172.183g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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