2,6,10-Trimethyltridecane - CAS 3891-99-4
Catalog: |
BB056961 |
Product Name: |
2,6,10-Trimethyltridecane |
CAS: |
3891-99-4 |
Synonyms: |
2,6,10-TRIMETHYLTRIDECANE; Tridecane, 2,6,10-trimethyl-; Tridecane, 2,6,10-trimethyl; 2,6,10-trimethyl-tridecane |
IUPAC Name: | 2,6,10-trimethyltridecane |
Description: | 2,6,10-Trimethyltridecane is a hydrocarbon isolated from butterfat. |
Molecular Weight: | 226.44 |
Molecular Formula: | C16H34 |
Canonical SMILES: | CCCC(C)CCCC(C)CCCC(C)C |
InChI: | InChI=1S/C16H34/c1-6-9-15(4)12-8-13-16(5)11-7-10-14(2)3/h14-16H,6-13H2,1-5H3 |
InChI Key: | MSRQAOLBRXEIHE-UHFFFAOYSA-N |
References: | Urbach, G., et al. J. Agric. Food Chem., 23, 20 (1975). |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.266051085 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.266051085 |
Rotatable Bond Count: | 10 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 8 |
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