| CAS Number | 93673-82-6 |
| Catalog Number | AG006ENS(AGN-PC-0NL6HT) |
| Chemical Name | Propanoic acid, 3-(2-hydroxyethoxy)-, methyl ester |
| IUPAC Name | methyl 3-(2-hydroxyethoxy)propanoate |
| InChI | InChI=1S/C6H12O4/c1-9-6(8)2-4-10-5-3-7/h7H,2-5H2,1H3 |
| InChI Key | CQAKPCZOXXRLJA-UHFFFAOYSA-N |
| MDL Number | MFCD10689834 |
| Molecular Formula | C6H12O4 |
| Molecular Weight | 148.1571 |
| SMILES | OCCOCCC(=O)OC |
| Synonyms | 93673-82-6,
METHYL 3-(2-HYDROXYETHOXY)PROPANOATE,
Propanoic acid, 3-(2-hydroxyethoxy)-, methyl ester,
ACMC-20lxyj,
Hydroxy-PEG1-methyl ester,
SCHEMBL9472095,
CTK3F5700,
DTXSID10579595,
ZINC26515424,
AKOS023093363,
BP-23577,
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| Complexity | 91.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 148.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 148.158g/mol |
| Monoisotopic Mass | 148.074g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number