| CAS Number | 1124194-63-3 |
| Catalog Number | AG007TA9(AGN-PC-0WCY6L) |
| Chemical Name | N-(4-Formylpyridin-3-yl)acetamide |
| IUPAC Name | N-(4-formylpyridin-3-yl)acetamide |
| InChI | InChI=1S/C8H8N2O2/c1-6(12)10-8-4-9-3-2-7(8)5-11/h2-5H,1H3,(H,10,12) |
| InChI Key | QXEFMYBPXJVIHG-UHFFFAOYSA-N |
| MDL Number | MFCD13689206 |
| Molecular Formula | C8H8N2O2 |
| Molecular Weight | 164.1613 |
| SMILES | O=CC1=C(NC(C)=O)C=NC=C1 |
| Synonyms | N-(4-formylpyridin-3-yl)acetamide,
1124194-63-3,
3-(ACETYLAMINO)-4-PYRIDIN-FORMALDEHYDE,
SCHEMBL3231667,
CTK8D3684,
DTXSID60676341,
MFCD13689206,
ZINC67172021,
AKOS015841072,
FCH1140922,
Acetamide, N-(4-formyl-3-pyridinyl)-,
AS-37256,
AB0075700,
AX8266771,
TC-010333,
X-1166,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.164g/mol |
| Monoisotopic Mass | 164.059g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 59.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H301
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P280-P305+P351+P338-P304+P340-P405-P501
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number