| CAS Number | 14966-80-4 |
| Catalog Number | AG001LWI(AGN-PC-00KXM4) |
| Chemical Name | 1-Cyclopentyl-2-methoxyethan-1-one |
| IUPAC Name | 1-cyclopentyl-2-methoxyethanone |
| InChI | InChI=1S/C8H14O2/c1-10-6-8(9)7-4-2-3-5-7/h7H,2-6H2,1H3 |
| InChI Key | PYPUDSQLJBSGCQ-UHFFFAOYSA-N |
| MDL Number | MFCD11555828 |
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.1956 |
| SMILES | COCC(C1CCCC1)=O |
| Synonyms | 1-Cyclopentyl-2-methoxyethanone,
14966-80-4,
1-cyclopentyl-2-methoxyethan-1-one,
Ethanone, 1-cyclopentyl-2-methoxy-,
CTK0E8669,
DTXSID70518460,
ZINC43504767,
AKOS010815270,
NE18084,
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| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.198g/mol |
| Monoisotopic Mass | 142.099g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
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