| CAS Number | 103095-52-9 |
| Catalog Number | AG00863D(AGN-PC-03YN7X) |
| Chemical Name | 5-Methyl-1-Phenyl-1H-Pyrazol-4-Amine |
| IUPAC Name | 5-methyl-1-phenylpyrazol-4-amine |
| InChI | InChI=1S/C10H11N3/c1-8-10(11)7-12-13(8)9-5-3-2-4-6-9/h2-7H,11H2,1H3 |
| InChI Key | WKNBWNUOHCWCAJ-UHFFFAOYSA-N |
| MDL Number | MFCD16042711 |
| Molecular Formula | C10H11N3 |
| Molecular Weight | 173.2144 |
| SMILES | NC1=C(C)N(C2=CC=CC=C2)N=C1 |
| Synonyms | 5-methyl-1-phenyl-1H-pyrazol-4-amine,
103095-52-9,
1H-Pyrazol-4-amine, 5-methyl-1-phenyl-,
ACMC-20m5zo,
SCHEMBL33199,
CTK0D8732,
DTXSID20630469,
ZINC48218382,
AKOS010086369,
MCULE-3297365429,
NE24918,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.219g/mol |
| Monoisotopic Mass | 173.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number