| CAS Number | 20101-88-6 |
| Catalog Number | AG002D5W(AGN-PC-006XJB) |
| Chemical Name | 3-(Dimethylamino)propanamide |
| IUPAC Name | 3-(dimethylamino)propanamide |
| InChI | InChI=1S/C5H12N2O/c1-7(2)4-3-5(6)8/h3-4H2,1-2H3,(H2,6,8) |
| InChI Key | NIXQLMVKRBUSPF-UHFFFAOYSA-N |
| MDL Number | MFCD04343934 |
| Molecular Formula | C5H12N2O |
| Molecular Weight | 116.1616 |
| SMILES | CN(CCC(N)=O)C |
| Synonyms | 3-(Dimethylamino)propanamide,
20101-88-6,
Propanamide, 3-(dimethylamino)-,
3-(n,n-dimethylamino)propylamide,
SCHEMBL177426,
ZINC8091109,
AKOS009086831,
SC-89196,
3-dimethylaminopropanamide,
Propanamide,3-(dimethylamino)-,
CID11330431,
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| Complexity | 80.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 116.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 116.164g/mol |
| Monoisotopic Mass | 116.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number