| CAS Number | 137434-61-8 |
| Catalog Number | AG00AH2M(AGN-PC-0O1D2J) |
| Chemical Name | 5-methyl-1H-1,2,3-benzotriazol-4-amine |
| IUPAC Name | 5-methyl-2H-benzotriazol-4-amine |
| InChI | InChI=1S/C7H8N4/c1-4-2-3-5-7(6(4)8)10-11-9-5/h2-3H,8H2,1H3,(H,9,10,11) |
| InChI Key | PSSNUWSDXCWZDV-UHFFFAOYSA-N |
| MDL Number | MFCD00962616 |
| Molecular Formula | C7H8N4 |
| Molecular Weight | 148.1652 |
| SMILES | CC1=C(N)C2=C(NN=N2)C=C1 |
| Synonyms | 137434-61-8,
5-Methyl-1H-1,2,3-benzotriazol-4-amine,
5-Methyl-1H-benzo[d][1,2,3]triazol-4-amine,
SCHEMBL1019781,
ZX-RL001664,
4039AD,
FCH942899,
MFCD00962616,
ZINC39048320,
AKOS006362172,
AS-9386,
OR110760,
1H-Benzotriazol-4-amine,5-methyl-(9CI),
C7H8N4,
1H-Benzotriazol-4-amine, 5-methyl- (9CI),
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 148.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 148.169g/mol |
| Monoisotopic Mass | 148.075g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number