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126354-09-4 | 2-Tridecanone, 10-methyl-
CAS No: 126354-09-4 Catalog No: AG000SP7 MDL No:
Product Description
Catalog Number:
AG000SP7
Chemical Name:
2-Tridecanone, 10-methyl-
CAS Number:
126354-09-4
Molecular Formula:
C14H28O
Molecular Weight:
212.3715
IUPAC Name:
10-methyltridecan-2-one
InChI:
InChI=1S/C14H28O/c1-4-10-13(2)11-8-6-5-7-9-12-14(3)15/h13H,4-12H2,1-3H3
InChI Key:
NJTTWHKSGLGWQM-UHFFFAOYSA-N
SMILES:
CCCC(CCCCCCCC(=O)C)C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.214g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.377g/mol
Monoisotopic Mass:
212.214g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
Literature
| Title | Journal |
|---|---|
| Metathesis-mediated synthesis of (R)-10-methyl-2-tridecanone, the southern corn rootworm pheromone. | Bioscience, biotechnology, and biochemistry 20120101 |
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