| Phytochemical Name : Methylparaben |
| PCNDIDM0125 |
| Pubchem CID : 7456 |
| Molecular formula: C8H8O3 |
| Canonical SMILES : COC(=O)C1=CC=C(C=C1)O |
Synonymes : Methyl 4-hydroxybenzoate|METHYLPARABEN|99-76-3|Methyl paraben|Methyl p-hydroxybenzoate|Nipagin|Methyl parahydroxybenzoate|Tegosept M|Moldex|Maseptol|p-Methoxycarbonylphenol|Preserval M|p-Carbomethoxyphenol|p-Hydroxybenzoic acid methyl ester|Methaben|Metoxyde|Preserval|Metaben|Paridol|Septos|Solbrol|Methyl parasept|Methyl butex|Benzoic acid, 4-hydroxy-, methyl ester|Methyl chemosept|Nipagin M|4-Hydroxybenzoic acid methyl ester|Aseptoform|Methylben|Abiol|Methyl p-oxybenzoate|Methyl-p-hydroxybenzoate|Solbrol M|4-(Methoxycarbonyl)phenol|FEMA No. 2710|4-Hydroxybenzoic acid, methyl ester|p-Hydroxybenzoic methyl ester|p-Oxybenzoesauremethylester|Methyl ester of p-hydroxybenzoic acid|Killitol|Caswell No. 573PP|FEMA Number 2710|Benzoic acid, p-hydroxy-, methyl ester|Methylparaben e218|NSC 3827|Methylparaben [USAN]|MFCD00002352|CCRIS 3946|HSDB 1184|Methyl paraben (e218)|methyl 4- hydroxybenzoate|Methyl-d3Paraben|UNII-A2I8C7HI9T|NSC-3827|p-Hydroxybenzoic acid, methyl ester|EINECS 202-785-7|A2I8C7HI9T|Methylester kyseliny p-hydroxybenzoove|EPA Pesticide Chemical Code 061201|NSC-406127|BRN 0509801|INS NO.218|methyl hydroxybenzoate|DTXSID4022529|INS number 218|CHEBI:31835|Methylis hydroxybenzoas|AI3-01336|INS-218|4-HYDROXY-BENZOIC ACID METHYL ESTER|p-Oxybenzoesauremethylester [German]|Methylparaben [USAN:NF]|E218|4-hydroxybenzoate methyl ester|INS No. 218|CHEMBL325372|DTXCID402529|E-218|Methylester kyseliny p-hydroxybenzoove [Czech]|NSC3827|EC 202-785-7|4-Hydroxybenzoic acid-methyl ester|NCGC00159376-02|NCGC00159376-04|E 218|METHYLPARABEN (II)|METHYLPARABEN [II]|WLN: QR DVO1|METHYL 4-HYDROXYBENZOATE-2,3,5,6-D4|4-Hydroxybenzoic acid-methyl ester 1000 microg/mL in Acetonitrile|METHYL HYDROXYBENZOATE (MART.)|METHYL HYDROXYBENZOATE [MART.]|CAS-99-76-3|SMR000036660|METHYL PARAHYDROXYBENZOATE (EP MONOGRAPH)|METHYL PARAHYDROXYBENZOATE [EP MONOGRAPH]|METHYL SALICYLATE IMPURITY C (EP IMPURITY)|METHYL SALICYLATE IMPURITY C [EP IMPURITY]|PROPYL HYDROXYBENZOATE IMPURITY B (EP IMPURITY)|PROPYL HYDROXYBENZOATE IMPURITY B [EP IMPURITY]|Metagin|methyl-paraben|METHYL4-HYDROXYBENZOATE|Lexgard M|Paraben M|(Methyl Paraben)|Methylparaben, NF|Methylparaben, FCC|4-carbomethoxyphenol|Methylparaben (NF)|Methylparaben (TN)|Solparol (Salt/Mix)|methyl 4-hydoxybenzoate|methyl-4-hydroxybenzoat|methyl 4 hydroxybenzoate|methyl 4-hydroxylbenzoate|p-(methoxycarbonyl)phenol|methyl 4-hydroxy-benzoate|methyl-4-hydroxy-benzoate|Methyl 4-?Hydroxybenzoate|METHYLPARABEN [MI]|Preserval MS (Salt/Mix)|bmse010009|D0T3NP|methyl (4-hydroxy)benzoate|METHYLPARABEN [FCC]|cid_7456|SCHEMBL4440|METHYLPARABEN [HSDB]|METHYLPARABEN [INCI]|METHYLPARABEN [VANDF]|MLS001304047|MLS001304187|BIDD:ER0241|Methyl 4-Hydroxybenzoate,(S)|METHYL PARABEN [VANDF]|METHYLPARABEN [USP-RS]|METHYLPARABEN [WHO-DD]|AMY901|GTPL6273|Methyl parahydroxybenzoate (TN)|4-Hydroxybenzoic acid methylester|methyl 4-hydroxybenzenecarboxylate|HMS2883I08|Methyl Paraben, analytical standard|Methyl parahydroxybenzoate (JP17)|4-hydroxy benzoic acid methyl ester|CS-D1181|HY-N0349|Tox21_111616|Tox21_202318|Tox21_300009|BBL005648|BDBM50209100|CK1194|NSC406127|s3985|STK802470|AKOS000119910|benzoic acid, p-hydroxy-,methyl ester|Tox21_111616_1|CCG-266228|DB14212|METHYL HYDROXYBENZOATE [WHO-IP]|METHYL P-HYDROXYBENZOATE [FHFI]|METHYL PARAHYDROXYBENZOATE [JAN]|USEPA/OPP Pesticide Code: 061201|Methyl 4-hydroxybenzoate, >=99%, FCC|NCGC00159376-03|NCGC00159376-05|NCGC00159376-06|NCGC00253939-01|NCGC00259867-01|LS-37618|SY006626|BENZOIC ACID,4-HYDROXY,METHYL ESTER|BB 0263150|FT-0618697|FT-0672044|H0216|M2206|Methyl 4-hydroxybenzoate, analytical standard|Methyl 4-hydroxybenzoate, p.a., 98-102%|EN300-15481|METHYLIS HYDROXYBENZOAS [WHO-IP LATIN]|D01400|Methyl 4-hydroxybenzoate, USP, 98.0-102.0%|A846079|Q229987|Q-200479|Methyl 4-hydroxybenzoate, SAJ first grade, >=98.0%|Methyl 4-hydroxybenzoate, tested according to Ph.Eur.|Z19674820|F1908-0119|Methyl 4-hydroxybenzoate, BioXtra, >=99.0% (titration)|Methylparaben, certified reference material, TraceCERT(R)|Methyl 4-hydroxybenzoate, ReagentPlus(R), >=99.0%, crystalline|Methylparaben, United States Pharmacopeia (USP) Reference Standard|Methyl 4-hydroxybenzoate, BioReagent, suitable for insect cell culture|Methyl parahydroxybenzoate, European Pharmacopoeia (EP) Reference Standard|Methylparaben, Pharmaceutical Secondary Standard; Certified Reference Material |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 1.630 |
| Log Po/w (XLOGP3) : 1.960 |
| Log Po/w (WLOGP) : 1.180 |
| Log Po/w (MLOGP) : 1.320 |
| Log Po/w (SILICOS-IT) : 1.210 |
| Consensus Log Po/w : 1.460 |

