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114749-81-4 | Pentacosane, 5,17-dimethyl-
CAS No: 114749-81-4 Catalog No: AG000F5H MDL No:
Product Description
Catalog Number:
AG000F5H
Chemical Name:
Pentacosane, 5,17-dimethyl-
CAS Number:
114749-81-4
Molecular Formula:
C27H56
Molecular Weight:
380.7335
IUPAC Name:
5,17-dimethylpentacosane
InChI:
InChI=1S/C27H56/c1-5-7-9-10-16-19-24-27(4)25-21-18-15-13-11-12-14-17-20-23-26(3)22-8-6-2/h26-27H,5-25H2,1-4H3
InChI Key:
CMYHRIYCOQTQRW-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(CCCCCCCCCCCC(CCCC)C)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.438g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
380.745g/mol
Monoisotopic Mass:
380.438g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
14.3
Literature
| Title | Journal |
|---|---|
| Cuticular hydrocarbons and soldier defense secretions of Reticulitermes in southern California: a critical analysis of the taxonomy of the genus in North America. | Journal of chemical ecology 20081101 |
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