| CAS Number | 6641-84-5 |
| Catalog Number | AG003HK2(AGN-PC-0JNBCA) |
| Chemical Name | 2-Methoxyethyl 12-hydroxyoctadecanoate |
| IUPAC Name | 2-methoxyethyl 12-hydroxyoctadecanoate |
| InChI | InChI=1S/C21H42O4/c1-3-4-5-12-15-20(22)16-13-10-8-6-7-9-11-14-17-21(23)25-19-18-24-2/h20,22H,3-19H2,1-2H3 |
| InChI Key | LKTMQTARNSGNGM-UHFFFAOYSA-N |
| MDL Number | MFCD30145918 |
| Molecular Formula | C21H42O4 |
| Molecular Weight | 358.5558 |
| NSC Number | 7398 |
| SMILES | CCCCCCC(O)CCCCCCCCCCC(OCCOC)=O |
| Synonyms | 2-methoxyethyl 12-hydroxyoctadecanoate,
6641-84-5,
NSC7398,
AC1L5BAH,
CTK5C4703,
AC1Q6892,
KS-000001PD,
NSC-7398,
MFCD30145918,
AKOS028108606,
2-methoxyethyl12-hydroxyoctadecanoate,
AR-1E3185,
CID222095,
12-hydroxy-octadecanoic acid-(2-methoxy-ethyl ester),
76833-35-7,
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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 | 358.308g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 358.563g/mol |
| Monoisotopic Mass | 358.308g/mol |
| Rotatable Bond Count | 20 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number