| CAS Number | 3658-44-4 |
| Catalog Number | AG0039AI(AGN-PC-0JTPUU) |
| Chemical Name | Dodecanoic acid, undecyl ester |
| IUPAC Name | undecyl dodecanoate |
| InChI | InChI=1S/C23H46O2/c1-3-5-7-9-11-13-15-17-19-21-23(24)25-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3 |
| InChI Key | JHDNXONYKMEEBK-UHFFFAOYSA-N |
| MDL Number | MFCD00380543 |
| Molecular Formula | C23H46O2 |
| Molecular Weight | 354.6101 |
| SMILES | C(CCCCCCCCCCC)(=O)OCCCCCCCCCCC |
| Synonyms | Dodecanoic acid, undecyl ester,
undecyl dodecanoate,
3658-44-4,
Lauric acid undecyl ester,
Undecyl laurate #,
AC1LCXDO,
SCHEMBL3658999,
JHDNXONYKMEEBK-UHFFFAOYSA-N,
MFCD00380543,
AKOS030228048,
KS-00000032,
Undecyl laurate,
CID608380,
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| Complexity | 263 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 354.35g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 354.619g/mol |
| Monoisotopic Mass | 354.35g/mol |
| Rotatable Bond Count | 21 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 10.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number