| CAS Number | 345205-43-8 |
| Catalog Number | AG01A3NP(AGN-PC-0WOMT4) |
| Chemical Name | 3,4-diamino-N,N-dimethylbenzamide |
| IUPAC Name | 3,4-diamino-N,N-dimethylbenzamide |
| InChI | InChI=1S/C9H13N3O/c1-12(2)9(13)6-3-4-7(10)8(11)5-6/h3-5H,10-11H2,1-2H3 |
| InChI Key | IFXIZQSFJBDAAR-UHFFFAOYSA-N |
| MDL Number | MFCD18338463 |
| Molecular Formula | C9H13N3O |
| Molecular Weight | 179.2190 |
| SMILES | CN(C(C1=CC(N)=C(N)C=C1)=O)C |
| Synonyms | 3,4-diamino-N,N-dimethylbenzamide,
345205-43-8,
SCHEMBL6865515,
ZINC58267287,
AKOS012665673,
DA-06611,
FT-0737874,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.223g/mol |
| Monoisotopic Mass | 179.106g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 72.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
Lot Number