| CAS Number | 2449-10-7 |
| Catalog Number | AG00BQMA(AGN-PC-0JLPFR) |
| Chemical Name | Dihexyl sebacate |
| EC Number | 219-509-6 |
| IUPAC Name | dihexyl decanedioate |
| InChI | InChI=1S/C22H42O4/c1-3-5-7-15-19-25-21(23)17-13-11-9-10-12-14-18-22(24)26-20-16-8-6-4-2/h3-20H2,1-2H3 |
| InChI Key | GQIDSVPVVYHXAP-UHFFFAOYSA-N |
| MDL Number | MFCD00368178 |
| Molecular Formula | C22H42O4 |
| Molecular Weight | 370.5665 |
| SMILES | C(CCCCCCCCC(=O)OCCCCCC)(=O)OCCCCCC |
| Synonyms | Dihexyl sebacate,
dihexyl decanedioate,
2449-10-7,
Decanedioic acid, dihexyl ester,
Di-n-hexyl sebacate,
Sebacic acid dihexyl ester,
AC1L2P0S,
SCHEMBL305076,
AC1Q674R,
CTK4F3796,
DTXSID10179251,
GQIDSVPVVYHXAP-UHFFFAOYSA-N,
EINECS 219-509-6,
Decanedioic acid,1,10-dihexyl ester,
DECANEDIOIC ACID DIHEXYL ESTER,
CID75558,
AR-1I5240,
2547-03-7,
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| Complexity | 296 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 370.308g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 370.574g/mol |
| Monoisotopic Mass | 370.308g/mol |
| Rotatable Bond Count | 21 |
| Topological Polar Surface Area | 52.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number