| CAS Number | 474766-30-8 |
| Catalog Number | AG00E6KT(AGN-PC-0WO3WG) |
| Chemical Name | 3-(propylamino)pyrrolidine-2,5-dione |
| IUPAC Name | 3-(propylamino)pyrrolidine-2,5-dione |
| InChI | InChI=1S/C7H12N2O2/c1-2-3-8-5-4-6(10)9-7(5)11/h5,8H,2-4H2,1H3,(H,9,10,11) |
| InChI Key | ISCOKDCBGVPLPL-UHFFFAOYSA-N |
| MDL Number | MFCD02660304 |
| Molecular Formula | C7H12N2O2 |
| Molecular Weight | 156.1824 |
| SMILES | CCCNC1C(=O)NC(=O)C1 |
| Synonyms | 3-(propylamino)pyrrolidine-2,5-dione,
474766-30-8,
AC1Q2Y4J,
CTK6E5363,
AKOS003631471,
AKOS017269086,
NE12113,
2,5-Pyrrolidinedione,3-(propylamino)-(9CI),
EN300-61201,
Z57157218,
F1024-0007,
2,5-Pyrrolidinedione, 3-(propylamino)- (9CI),
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.185g/mol |
| Monoisotopic Mass | 156.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number