| CAS Number | 1211764-32-7 |
| Catalog Number | AG009DSR(AGN-PC-0WB5E3) |
| Chemical Name | 5-(hydroxymethyl)-N,N-dimethyl-2-furamide |
| IUPAC Name | 5-(hydroxymethyl)-N,N-dimethylfuran-2-carboxamide |
| InChI | InChI=1S/C8H11NO3/c1-9(2)8(11)7-4-3-6(5-10)12-7/h3-4,10H,5H2,1-2H3 |
| InChI Key | STHHXHFVSLGYAS-UHFFFAOYSA-N |
| MDL Number | MFCD13188559 |
| Molecular Formula | C8H11NO3 |
| Molecular Weight | 169.1778 |
| SMILES | C1(=CC=C(CO)O1)C(=O)N(C)C |
| Synonyms | 1211764-32-7,
5-(HYDROXYMETHYL)-N,N-DIMETHYL-2-FURAMIDE,
5-(Hydroxymethyl)-N,N-dimethylfuran-2-carboxamide,
DTXSID60672469,
ZX-CM007767,
FCH924029,
MFCD13188559,
ZINC42383777,
AKOS006333849,
MCULE-5499306625,
AJ-104274,
Y-7348,
5-(hydroxymethyl)-N,N-dimethyl-2-furamide(SALTDATA,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.18g/mol |
| Monoisotopic Mass | 169.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number