| CAS Number | 88986-89-4 |
| Catalog Number | AG00890D(AGN-PC-0KVQUP) |
| Chemical Name | 1-(2-Methoxyethoxy)propan-2-one |
| IUPAC Name | 1-(2-methoxyethoxy)propan-2-one |
| InChI | InChI=1S/C6H12O3/c1-6(7)5-9-4-3-8-2/h3-5H2,1-2H3 |
| InChI Key | MSYGEAQDQJEOCJ-UHFFFAOYSA-N |
| MDL Number | MFCD01105045 |
| Molecular Formula | C6H12O3 |
| Molecular Weight | 132.1577 |
| SMILES | COCCOCC(C)=O |
| Synonyms | 1-(2-methoxyethoxy)propan-2-one,
88986-89-4,
2-Propanone, 1-(2-methoxyethoxy)-,
ACMC-20lfx9,
AC1MRFG1,
1-(2-methoxyethoxy)acetone,
SCHEMBL805276,
CTK3A3762,
DTXSID50393232,
ZINC5377994,
AKOS009992982,
MCULE-5956367525,
ST50999787,
EN300-84318,
Z2418194310,
2-Propanone,1- -,
CID3517194,
2-Propanone, 1-(2-methoxyethoxy)- (9CI),
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| Complexity | 80.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 132.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 132.159g/mol |
| Monoisotopic Mass | 132.079g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number