| Phytochemical Name : Butyl octyl phthalate |
| PCNDIDB0155 |
| Pubchem CID : 66540 |
| Molecular formula: C20H30O4 |
| Canonical SMILES : CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC |
Synonymes : Butyl octyl phthalate|84-78-6|Plasticizer OBP|Staflex BOP|Octyl butyl phthalate|Plasticizer BOP|Truflex OBP|1,2-Benzenedicarboxylic acid, butyl octyl ester|PX 914|Phthalic acid, butyl octyl ester|1-O-butyl 2-O-octyl benzene-1,2-dicarboxylate|NSC 69894|EINECS 201-562-1|BRN 2289337|1,2-Benzenedicarboxylic acid, 1-butyl 2-octyl ester|UNII-Y52J9Q533Y|Phthalic acid, butyloctyl ester|Butyl octyl phthalate(Technical)|Y52J9Q533Y|NSC-69894|butyloctylphthalat-|1, butyl octyl ester|SCHEMBL50451|Cbz-DL-3-Aminoisobutyricacid|1-Butyl 2-octyl phthalate #|DTXSID2052578|AMY28401|NSC69894|MFCD00072261|Phthalic acid 1-butyl 2-octyl ester|AS-57441|LS-29757|1-butyl 2-octyl benzene-1,2-dicarboxylate|CS-0134595|C13887|A928579|Phthalic acid, butyl octyl ester (6CI,7CI,8CI)|Q27294278 |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 4.380 |
| Log Po/w (XLOGP3) : 5.930 |
| Log Po/w (WLOGP) : 5.160 |
| Log Po/w (MLOGP) : 4.370 |
| Log Po/w (SILICOS-IT) : 5.630 |
| Consensus Log Po/w : 5.090 |