| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 85-71-2 |
| ECHA EC Number: | 201-625-3 |
| FDA UNII: | 01HT00FI3B |
| Category: | indirect food additives: adhesives and components of coatings |
| IUPAC Name: | methyl phthalyl ethyl glycolate |
| InChI : | InChI=1/C13H14O6/c1-3-18-11(14)8-19-13(16)10-7-5-4-6-9(10)12(15)17-2/h4-7H,3,8H2,1-2H3 |
| Std.InChI: | InChI=1S/C13H14O6/c1-3-18-11(14)8-19-13(16)10-7-5-4-6-9(10)12(15)17-2/h4-7H,3,8H2,1-2H3 |
| InChIKey : | OYMDOVKIWFMTAW-UHFFFAOYAH |
| Std.InChIKey: | OYMDOVKIWFMTAW-UHFFFAOYSA-N |
| SMILES : | CCOC(=O)COC(=O)C1=CC=CC=C1C(=O)OC |
| Molar Refractivity : | 65.47 ± 0.3 cm3 (est) |
| Parachor : | 561.0 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.511 ± 0.02 (est) |
| Surface Tension : | 43.6 ± 3.0 dyne/cm (est) |
| Density : | 1.220 ± 0.06 g/cm3 (est) |
| Polarizability : | 25.95 ± 0.5 10-24cm3 (est) |
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| FDA Mainterm (IAUFC): | 85-71-2 ; METHYL PHTHALYL ETHYL GLYCOLATE |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Soluble in: | |
| water, 684.5 mg/L @ 25 °C (est) | |
| None found |
| None found |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| indirect food additives: adhesives and components of coatings | |||
| Recommendation for methyl phthalyl ethyl glycolate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for methyl phthalyl ethyl glycolate flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :221066 |
| National Institute of Allergy and Infectious Diseases:Data |
| 2-O-(2-ethoxy-2-oxoethyl) 1-O-methyl benzene-1,2-dicarboxylate |
| Chemidplus:0000085712 |
| 2-O-(2-ethoxy-2-oxoethyl) 1-O-methyl benzene-1,2-dicarboxylate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 221066 |
| Pubchem (cas): | 85-71-2 |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Indirect Additives used in Food Contact Substances: | View |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
| None Found |
| None Found |
| not found in nature |
| 1,2- | benzenedicarboxylic acid, 2-ethoxy-2-oxoethyl methyl ester |
| 2-O-(2- | ethoxy-2-oxoethyl) 1-O-methyl benzene-1,2-dicarboxylate |
| ethoxycarbonylmethyl methyl phthalate | |
| phthalic acid, monomethyl ester, ester with ethyl glycolate |
| None found yet. Try the PubMed Search. |
