Isophthalic acid, dodecyl methyl ester
3-O-dodecyl 1-O-methyl benzene-1,3-dicarboxylate
Also Known As: Isophthalic acid, dodecyl methyl ester|1-Dodecyl 3-methyl isophthalate #|Isophthalicacid1-dodecyl3-methylester|Isophthalic acid 1-dodecyl 3-methyl ester|1-dodecyl 3-methyl benzene-1,3-dicarboxylate|3-O-dodecyl 1-O-methyl benzene-1,3-dicarboxylate
CAS: 33975-26-7
| Molecular Formula | C21H32O4 |
|---|---|
| Molecular Weight | 348.23007 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 348.23007 |
| Monoisotopic Mass | 348.23007 |
| Heavy Atoms | 25 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 33975-26-7 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)C1=CC=CC(=C1)C(=O)OC |
| InChIKey | ORSGNGAZCWFZMX-UHFFFAOYSA-N |
Product Overview
Isophthalic acid, dodecyl methyl ester (CAS 33975-26-7), with molecular formula C21H32O4 and molecular weight 348.23007 g/mol. IUPAC: 3-O-dodecyl 1-O-methyl benzene-1,3-dicarboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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