| CAS Number | 3389-55-7 |
| Catalog Number | AG01BC5Q(AGN-PC-0JT04F) |
| Chemical Name | 2,2-Dimethyl-1-(pyrrolidin-1-yl)propan-1-one |
| IUPAC Name | 2,2-dimethyl-1-pyrrolidin-1-ylpropan-1-one |
| InChI | InChI=1S/C9H17NO/c1-9(2,3)8(11)10-6-4-5-7-10/h4-7H2,1-3H3 |
| InChI Key | BGWHWXSHXGWQNL-UHFFFAOYSA-N |
| MDL Number | MFCD01326710 |
| Molecular Formula | C9H17NO |
| Molecular Weight | 155.2374 |
| SMILES | CC(C(N1CCCC1)=O)(C)C |
| Synonyms | 2,2-dimethyl-1-(pyrrolidin-1-yl)propan-1-one,
3389-55-7,
2,2-Dimethyl-1-pyrrolidin-1-ylpropan-1-one,
1-(2,2-Dimethylpropanoyl)pyrrolidine,
1-Pivaloylpyrrolidine,
AC1LBYV4,
SCHEMBL803076,
CTK7F3778,
BGWHWXSHXGWQNL-UHFFFAOYSA-N,
ZINC5383548,
AKOS003854516,
1-(2,2-Dimethylpropanoyl)pyrrolidine #,
Z54127989,
F6541-1218,
CID566664,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.241g/mol |
| Monoisotopic Mass | 155.131g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number