| CAS Number | 550363-79-6 |
| Catalog Number | AG019L8A(AGN-PC-05EZK7) |
| Chemical Name | N-cyclopropyl-4-formylbenzamide |
| IUPAC Name | N-cyclopropyl-4-formylbenzamide |
| InChI | InChI=1S/C11H11NO2/c13-7-8-1-3-9(4-2-8)11(14)12-10-5-6-10/h1-4,7,10H,5-6H2,(H,12,14) |
| InChI Key | BBBUUEDBJUBFJI-UHFFFAOYSA-N |
| MDL Number | MFCD09863336 |
| Molecular Formula | C11H11NO2 |
| Molecular Weight | 189.2105 |
| SMILES | O=CC1=CC=C(C(NC2CC2)=O)C=C1 |
| Synonyms | N-cyclopropyl-4-formylbenzamide,
550363-79-6,
AC1Q6PT8,
SCHEMBL1663048,
CTK7H9346,
BBBUUEDBJUBFJI-UHFFFAOYSA-N,
4-cyclopropylaminocarbonylbenzaldehyde,
ZINC20281290,
AKOS015996447,
MCULE-8611205029,
4-(cyclopropylaminocarbonyl)benzaldehyde,
EN300-30427,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.214g/mol |
| Monoisotopic Mass | 189.079g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number