| CAS Number | 35394-09-3 |
| Catalog Number | AG00CMPN(AGN-PC-0NJ3LX) |
| Chemical Name | 2-METHOXYCYCLOPENTANONE |
| IUPAC Name | 2-methoxycyclopentan-1-one |
| InChI | InChI=1S/C6H10O2/c1-8-6-4-2-3-5(6)7/h6H,2-4H2,1H3 |
| InChI Key | OLNNYNLMEOFPET-UHFFFAOYSA-N |
| MDL Number | MFCD03701497 |
| Molecular Formula | C6H10O2 |
| Molecular Weight | 114.1424 |
| SMILES | COC1C(CCC1)=O |
| Synonyms | 2-METHOXYCYCLOPENTANONE,
35394-09-3,
2-METHOXYCYCLOPENTAN-1-ONE,
Cyclopentanone,2-methoxy-,
Cyclopentanone, 2-methoxy-,
SCHEMBL25999,
CTK4H4461,
DTXSID40499737,
OLNNYNLMEOFPET-UHFFFAOYSA-N,
AKOS006276712,
DA-06508,
FT-0748342,
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| Complexity | 98.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 114.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 114.144g/mol |
| Monoisotopic Mass | 114.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number