| CAS Number | 926229-59-6 |
| Catalog Number | AG01A9X2 |
| Chemical Name | 3-(aminomethyl)-N-(propan-2-yl)benzamide |
| IUPAC Name | 3-(aminomethyl)-N-propan-2-ylbenzamide |
| InChI | InChI=1S/C11H16N2O/c1-8(2)13-11(14)10-5-3-4-9(6-10)7-12/h3-6,8H,7,12H2,1-2H3,(H,13,14) |
| InChI Key | FAFLYOXNDXWVSR-UHFFFAOYSA-N |
| MDL Number | MFCD09046043 |
| Molecular Formula | C11H16N2O |
| Molecular Weight | 192.2575 |
| SMILES | CC(NC(C1=CC(CN)=CC=C1)=O)C |
| Synonyms | 3-(aminomethyl)-N-(propan-2-yl)benzamide,
926229-59-6,
Z1263529586,
3-(AMINOMETHYL)-N-ISOPROPYLBENZAMIDE,
AC1Q1Q6H,
CTK7E5258,
ZINC19722448,
AKOS000130040,
MCULE-5563751855,
NE55450,
EN300-66424,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.262g/mol |
| Monoisotopic Mass | 192.126g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number