| CAS Number | 76765-68-9 |
| Catalog Number | AG019UDH(AGN-PC-0NJL8I) |
| Chemical Name | 3-Amino-N,N,4-trimethylbenzamide |
| IUPAC Name | 3-amino-N,N,4-trimethylbenzamide |
| InChI | InChI=1S/C10H14N2O/c1-7-4-5-8(6-9(7)11)10(13)12(2)3/h4-6H,11H2,1-3H3 |
| InChI Key | SPENLBANQJYBEA-UHFFFAOYSA-N |
| MDL Number | MFCD09736902 |
| Molecular Formula | C10H14N2O |
| Molecular Weight | 178.2310 |
| SMILES | CN(C(C1=CC(N)=C(C)C=C1)=O)C |
| Synonyms | 3-amino-N,N,4-trimethylbenzamide,
76765-68-9,
AC1Q3VXT,
SCHEMBL11698215,
CTK6H9013,
3-Amino-4,N,N-trimethyl-benzamide,
ZINC20221045,
AKOS000111619,
MCULE-2092126654,
NE14357,
N,N-dimethyl-3-amino-4-methylbenzamide,
DA-03513,
BB 0246512,
FT-0717835,
EN300-41315,
A1-07006,
|
| Complexity | 191 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.235g/mol |
| Monoisotopic Mass | 178.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number