| CAS Number | 1203661-50-0 |
| Catalog Number | AG00HFFA(AGN-PC-0WCY8T) |
| Chemical Name | 1-(3,5-Dimethylphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine |
| IUPAC Name | 1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-amine |
| InChI | InChI=1S/C15H19N3/c1-10-6-11(2)8-12(7-10)18-15-5-3-4-14(16)13(15)9-17-18/h6-9,14H,3-5,16H2,1-2H3 |
| InChI Key | LFRTVNMBHGEHRH-UHFFFAOYSA-N |
| MDL Number | MFCD17926424 |
| Molecular Formula | C15H19N3 |
| Molecular Weight | 241.3315 |
| SMILES | CC1=CC(=CC(C)=C1)N1N=CC2=C1CCCC2N |
| Synonyms | 1203661-50-0,
1-(3,5-Dimethylphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine,
1-(3,5-DIMETHYL-PHENYL)-4-AMINO-4,5,6,7-TETRAHYDROINDAZOLE,
CHEMBL3478922,
MFCD17926424,
AKOS014691986,
MCULE-2951772946,
ABA-6385220,
AS-37839,
AX8266845,
X-2508,
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| Complexity | 284 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.338g/mol |
| Monoisotopic Mass | 241.158g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number