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16900-08-6 | Dodecane, 1-(butylthio)-
CAS No: 16900-08-6 Catalog No: AG001YFR MDL No:
Product Description
Catalog Number:
AG001YFR
Chemical Name:
Dodecane, 1-(butylthio)-
CAS Number:
16900-08-6
Molecular Formula:
C16H34S
Molecular Weight:
258.5062
IUPAC Name:
1-butylsulfanyldodecane
InChI:
InChI=1S/C16H34S/c1-3-5-7-8-9-10-11-12-13-14-16-17-15-6-4-2/h3-16H2,1-2H3
InChI Key:
BGSBXDJLUNXANY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCSCCCC
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.238g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.508g/mol
Monoisotopic Mass:
258.238g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
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