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13287-21-3 | Tridecane, 6-methyl-
CAS No: 13287-21-3 Catalog No: AG0011AU MDL No:
Product Description
Catalog Number:
AG0011AU
Chemical Name:
Tridecane, 6-methyl-
CAS Number:
13287-21-3
Molecular Formula:
C14H30
Molecular Weight:
198.3880
IUPAC Name:
6-methyltridecane
InChI:
InChI=1S/C14H30/c1-4-6-8-9-11-13-14(3)12-10-7-5-2/h14H,4-13H2,1-3H3
InChI Key:
SOMJQWRITYTQJL-UHFFFAOYSA-N
SMILES:
CCCCCCCC(CCCCC)C
Properties
Complexity:
96.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.235g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.394g/mol
Monoisotopic Mass:
198.235g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
Literature
| Title | Journal |
|---|---|
| Authentication of fattening diet of Iberian pigs according to their volatile compounds profile from raw subcutaneous fat. | Analytical and bioanalytical chemistry 20110201 |
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