| Phytochemical Name : Methyl heptadecanoate |
| PCNDIDM0103 |
| Pubchem CID : 15609 |
| Molecular formula: C18H36O2 |
| Canonical SMILES : CCCCCCCCCCCCCCCCC(=O)OC |
Synonymes : METHYL HEPTADECANOATE|1731-92-6|Methyl margarate|Heptadecanoic acid, methyl ester|Margaric acid methyl ester|Heptadecanoic acid methyl ester|methylheptadecanoate|UNII-41PZK7H0KL|41PZK7H0KL|n-Heptadecanoic acid methyl ester|EINECS 217-055-3|Heptadecanoic Acid Methyl Ester,(S)|NSC 97364|NSC-97364|AI3-36453|WE(1:0/17:0)|Heptadecanoic acid,methyl ester|formyl heptadecanoate|MFCD00009001|Heptadecanoic acid methyl|Methyl heptadecanoate, 95%|Methyl heptadecanoate, 99%|SCHEMBL346760|Heptadecanoic acid-methyl ester|Methyl heptadecanoate, >=99%|DTXSID3061924|CDAA-251017M|CHEBI:136920|NSC97364|LMFA07010473|AKOS015903907|CS-W004290|HY-W004290|AS-49344|Methyl heptadecanoate, analytical standard|FT-0726048|H0566|H10839|Methyl heptadecanoate, purum, >=95.0% (GC)|B6629AC7-DDCA-4BCF-AFB1-744D9D2EE8F5|Q24735110|Methyl heptadecanoate, certified reference material, TraceCERT(R) |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.920 |
| Log Po/w (XLOGP3) : 7.810 |
| Log Po/w (WLOGP) : 6.030 |
| Log Po/w (MLOGP) : 4.670 |
| Log Po/w (SILICOS-IT) : 6.280 |
| Consensus Log Po/w : 5.940 |