| CAS Number | 63492-36-4 |
| Catalog Number | AG01ANA6(AGN-PC-0CQNOW) |
| Chemical Name | bicyclo[3.2.0]heptan-3-one |
| IUPAC Name | bicyclo[3.2.0]heptan-3-one |
| InChI | InChI=1S/C7H10O/c8-7-3-5-1-2-6(5)4-7/h5-6H,1-4H2 |
| InChI Key | RXGDWZCMJCMFNW-UHFFFAOYSA-N |
| MDL Number | MFCD24689329 |
| Molecular Formula | C7H10O |
| Molecular Weight | 110.1537 |
| SMILES | O=C1CC2C(CC2)C1 |
| Synonyms | Bicyclo[3.2.0]heptan-3-one,
63492-36-4,
bicyclo[3.2.0]hept-3-one,
SCHEMBL4515462,
RXGDWZCMJCMFNW-UHFFFAOYSA-N,
AKOS023200115,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 110.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 110.156g/mol |
| Monoisotopic Mass | 110.073g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number