| CAS Number | 777055-55-7 |
| Catalog Number | AG00ICVN(AGN-PC-0WOJ9Y) |
| Chemical Name | N-Ethyl 4-(aminomethyl)benzamide |
| IUPAC Name | 4-(aminomethyl)-N-ethylbenzamide |
| InChI | InChI=1S/C10H14N2O/c1-2-12-10(13)9-5-3-8(7-11)4-6-9/h3-6H,2,7,11H2,1H3,(H,12,13) |
| InChI Key | YUCCNGHVNHMOBD-UHFFFAOYSA-N |
| MDL Number | MFCD09050879 |
| Molecular Formula | C10H14N2O |
| Molecular Weight | 178.2310 |
| SMILES | CCNC(C1=CC=C(CN)C=C1)=O |
| Synonyms | 4-(aminomethyl)-N-ethylbenzamide,
N-Ethyl 4-(aminomethyl)benzamide,
777055-55-7,
AC1Q31AV,
SCHEMBL13461011,
CTK6F1918,
KM3560,
MFCD09050879,
ZINC22150717,
AKOS000134339,
MCULE-6518346297,
EN300-40522,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.235g/mol |
| Monoisotopic Mass | 178.111g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number