| CAS Number | 89547-15-9 |
| Catalog Number | AG003HD0(AGN-PC-0JTZWC) |
| Chemical Name | 2-N-HEXADECYLSTEARIC ACID |
| IUPAC Name | 2-hexadecyloctadecanoic acid |
| InChI | InChI=1S/C34H68O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33(34(35)36)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33H,3-32H2,1-2H3,(H,35,36) |
| InChI Key | LPZKXVVBAZTEMK-UHFFFAOYSA-N |
| MDL Number | MFCD00191519 |
| Molecular Formula | C34H68O2 |
| Molecular Weight | 508.9025 |
| SMILES | C(CCCCCCCCCCCCCCC)C(C(=O)O)CCCCCCCCCCCCCCCC |
| Synonyms | 2-Hexadecyloctadecanoic acid,
89547-15-9,
2-Hexadecylstearic acid,
2-n-hexadecylstearic acid,
AC1LCDOD,
ACMC-209r1m,
SCHEMBL313999,
2-Hexadecyloctadecanoic acid #,
CTK6D9585,
DTXSID60347726,
LPZKXVVBAZTEMK-UHFFFAOYSA-N,
ZINC8383153,
ANW-39320,
MFCD00191519,
AKOS015839812,
TR-028114,
AI-942/42301824,
2-hexadecylstearicacid,
2-N-HEXADECYLSTEARICACID,
CID625165,
H0837,
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| Complexity | 387 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 508.522g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 508.916g/mol |
| Monoisotopic Mass | 508.522g/mol |
| Rotatable Bond Count | 31 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 16.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number