| CAS Number | 73018-16-3 |
| Catalog Number | AG005CY6(AGN-PC-00318Q) |
| Chemical Name | 5,5-Dimethyl-3-methylidenepyrrolidin-2-one |
| IUPAC Name | 5,5-dimethyl-3-methylidenepyrrolidin-2-one |
| InChI | InChI=1S/C7H11NO/c1-5-4-7(2,3)8-6(5)9/h1,4H2,2-3H3,(H,8,9) |
| InChI Key | MWCXFAZRURQVTI-UHFFFAOYSA-N |
| MDL Number | MFCD24550607 |
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.1683 |
| SMILES | O=C1(NC(C)(C)CC1=C) |
| Synonyms | 5,5-Dimethyl-3-methylidenepyrrolidin-2-one,
73018-16-3,
2-Pyrrolidinone, 5,5-dimethyl-3-methylene-,
SCHEMBL20702295,
CTK2H1838,
KS-00002BGG,
DTXSID70565611,
ZINC34410669,
AKOS030255466,
SS-4961,
3-Methylene-5,5-dimethylpyrrolidine-2-one,
3,3-methylene-5,5-dimethyl-2-pyrrolidinone,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.171g/mol |
| Monoisotopic Mass | 125.084g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number