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160435-42-7 | 1-Decanol, octyl-
CAS No: 160435-42-7 Catalog No: AG001RWF MDL No:
Product Description
Catalog Number:
AG001RWF
Chemical Name:
1-Decanol, octyl-
CAS Number:
160435-42-7
Molecular Formula:
C18H38O
Molecular Weight:
270.4937
IUPAC Name:
octadecan-9-ol
InChI:
InChI=1S/C18H38O/c1-3-5-7-9-11-13-15-17-18(19)16-14-12-10-8-6-4-2/h18-19H,3-17H2,1-2H3
InChI Key:
URMHMMMIVAECEM-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(CCCCCCCC)O
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.292g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.501g/mol
Monoisotopic Mass:
270.292g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1
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