| CAS Number | 79162-70-2 |
| Catalog Number | AG00G2DK |
| Chemical Name | METHYL 30-HYDROXYTRIACONTANOATE |
| IUPAC Name | methyl 30-hydroxytriacontanoate |
| InChI | InChI=1S/C31H62O3/c1-34-31(33)29-27-25-23-21-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32/h32H,2-30H2,1H3 |
| InChI Key | KLQWCGJZHUFBOA-UHFFFAOYSA-N |
| MDL Number | MFCD02259081 |
| Molecular Formula | C31H62O3 |
| Molecular Weight | 482.8222 |
| SMILES | OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC |
| Synonyms | METHYL 30-HYDROXYTRIACONTANOATE,
SCHEMBL4758137,
CTK8A4156,
ZINC14511056,
79162-70-2,
|
| Complexity | 383 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 482.47g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 34 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 482.834g/mol |
| Monoisotopic Mass | 482.47g/mol |
| Rotatable Bond Count | 30 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 13.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number