| CAS Number | 27986-38-5 |
| Catalog Number | AG003S01(AGN-PC-0R3MAG) |
| Chemical Name | Methyl Dichlorostearate |
| IUPAC Name | methyl 2,2-dichlorooctadecanoate |
| InChI | InChI=1S/C19H36Cl2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(20,21)18(22)23-2/h3-17H2,1-2H3 |
| InChI Key | HDINWBRYKNUCEC-UHFFFAOYSA-N |
| MDL Number | MFCD00060077 |
| Molecular Formula | C19H36Cl2O2 |
| Molecular Weight | 367.3939 |
| SMILES | CCCCCCCCCCCCCCCCC(C(=O)OC)(Cl)Cl |
| Synonyms | 27986-38-5,
ACMC-1CJKQ,
SCHEMBL9547823,
CTK4G0592,
methyl 2,2-dichlorooctadecanoate,
DTXSID60707285,
MFCD00060077,
x,x-Dichlorostearic acid methyl ester,
TC-166147,
FT-0769654,
Octadecanoic acid,dichloro-, methyl ester (9CI),
METHYL DICHLOROSTEARATE,
Methyl Dichlorooctadecanoate,
Dichlorooctadecanoic Acid Methyl Ester,
Dichlorostearic Acid Methyl Ester,
D0999,
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| Complexity | 281 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 366.209g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 367.395g/mol |
| Monoisotopic Mass | 366.209g/mol |
| Rotatable Bond Count | 17 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 9.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number