| CAS Number | 39581-30-1 |
| Catalog Number | AG01AHQ3(AGN-PC-0NIFUJ) |
| Chemical Name | 2-Cyano-N-methyl-N-phenylacetamide |
| IUPAC Name | 2-cyano-N-methyl-N-phenylacetamide |
| InChI | InChI=1S/C10H10N2O/c1-12(10(13)7-8-11)9-5-3-2-4-6-9/h2-6H,7H2,1H3 |
| InChI Key | TYNMTKVSZGKSFB-UHFFFAOYSA-N |
| MDL Number | MFCD09943548 |
| Molecular Formula | C10H10N2O |
| Molecular Weight | 174.1992 |
| SMILES | C(#N)CC(=O)N(C1=CC=CC=C1)C |
| Synonyms | 2-Cyano-N-methyl-n-phenylacetamide,
39581-30-1,
cyanoacetic methylphenyl amide,
N-(Cyanoacetyl)-N-methylaniline,
SCHEMBL11209904,
KS-00003KP4,
HTS028334,
MFCD09943548,
ZINC19502984,
AKOS000187364,
FS-2311,
MCULE-3850415867,
NE28106,
BB 0218844,
EN300-75466,
Z1267773732,
C10H10N2O,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.203g/mol |
| Monoisotopic Mass | 174.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number