| CAS Number | 41448-83-3 |
| Catalog Number | AG01BICT(AGN-PC-0JD6RF) |
| Chemical Name | 3-Methoxypropyl acetate |
| IUPAC Name | 3-methoxypropyl acetate |
| InChI | InChI=1S/C6H12O3/c1-6(7)9-5-3-4-8-2/h3-5H2,1-2H3 |
| InChI Key | CCTFMNIEFHGTDU-UHFFFAOYSA-N |
| MDL Number | MFCD00040553 |
| Molecular Formula | C6H12O3 |
| Molecular Weight | 132.1577 |
| SMILES | COCCCOC(C)=O |
| Synonyms | 3-Methoxypropyl acetate,
41448-83-3,
methoxypropylacetate,
acetic acid-(3-methoxy-propyl ester),
methoxy propanol acetate,
AC1LBJG0,
SCHEMBL16025,
CTK7B3142,
Acetic acid 3-methoxypropyl ester,
CCTFMNIEFHGTDU-UHFFFAOYSA-N,
ZINC14679819,
AKOS033058412,
SC-26578,
J3.653.349H,
Z1123440688,
Methoxypropyl acetate,
CID536841,
84540-57-8,
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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