| Phytochemical Name : 2-(Methoxycarbonyl)benzoic acid |
| PCNDIDOT0470 |
| Pubchem CID : 20392 |
| Molecular formula: C9H8O4 |
| Canonical SMILES : COC(=O)C1=CC=CC=C1C(=O)O |
Synonymes : 2-(Methoxycarbonyl)benzoic acid|4376-18-5|Methyl hydrogen phthalate|MONOMETHYL PHTHALATE|mono-Methyl phthalate|2-methoxycarbonylbenzoic acid|1,2-Benzenedicarboxylic acid, monomethyl ester|o-(Methoxycarbonyl)benzoic acid|Phthalic acid, monomethyl ester|Phthalic acid monomethyl ester|Monomethyl 1,2-benzenedicarboxylate|D 3 (ester)|NSC 8281|Methyl phthalate (VAN)|MFCD00002466|UNII-2STT6D18JR|Phthalic acid, methyl ester|2STT6D18JR|DTXSID9040001|CHEBI:89749|D 3 (VAN)|NSC-8281|EINECS 224-476-6|D 3|AI3-02332|Methyl 2-Carboxybenzoate|2-(1-Methoxycarbonyl)benzoic Acid|Phthalic acid 1-methyl|2-carbomethoxybenzoic acid|1,2-benzenedicarboxylic acid monomethyl ester|1,2-benzenedicarboxylic acid, 1-methyl ester|O-(methoxycarbonyl)benzoate|2-(Methoxycarbonyl)benzoate|BIDD:PXR0156|SCHEMBL40534|MMP (Mono-methyl phthalate)|Mono-methyl phthalate (MMP)|mono-Methyl phthalate, 97%|2-(Methoxycarbonyl)benzoicacid|CHEMBL243609|DTXCID7020001|Phthalic acid, mono-methyl ester|NSC8281|2-(Methoxycarbonyl)benzoic acid #|CS-D1453|HY-Y1097|Tox21_300735|STK387125|AKOS000278869|NCGC00164438-01|NCGC00164438-02|NCGC00164438-03|NCGC00164438-04|NCGC00254641-01|BP-13059|mono-Methyl phthalate, analytical standard|SY010760|TS-02513|CAS-4376-18-5|AM20060631|FT-0628330|FT-0672488|EN300-67468|AB01334586-02|AR-360/13197749|J-506453|Q26840745|F1791-1742|Z1080376828 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.440 |
| Log Po/w (XLOGP3) : 1.130 |
| Log Po/w (WLOGP) : 1.170 |
| Log Po/w (MLOGP) : 1.510 |
| Log Po/w (SILICOS-IT) : 1.100 |
| Consensus Log Po/w : 1.270 |