| CAS Number | 1227465-53-3 |
| Catalog Number | AG009DYN(AGN-PC-0WB5FV) |
| Chemical Name | 1-ethyl-4-(hydroxymethyl)pyrrolidin-2-one |
| IUPAC Name | 1-ethyl-4-(hydroxymethyl)pyrrolidin-2-one |
| InChI | InChI=1S/C7H13NO2/c1-2-8-4-6(5-9)3-7(8)10/h6,9H,2-5H2,1H3 |
| InChI Key | IQUCSWPMKAMAQG-UHFFFAOYSA-N |
| MDL Number | MFCD14702859 |
| Molecular Formula | C7H13NO2 |
| Molecular Weight | 143.1836 |
| SMILES | N1(CC)CC(CC1=O)CO |
| Synonyms | 1-ethyl-4-(hydroxymethyl)pyrrolidin-2-one,
1227465-53-3,
1-ETHYL-4-(HYDROXYMETHYL)-2-PYRROLIDINONE,
DTXSID00677751,
MFCD14702859,
AKOS013490954,
MCULE-2549229010,
EN300-82068,
Y-7502,
1-ethyl-4-(hydroxymethyl)-2-pyrrolidinone(SALTDATA,
F2147-0772,
Z1250132797,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.186g/mol |
| Monoisotopic Mass | 143.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number