| CAS Number | 75427-10-0 |
| Catalog Number | AG019UCC |
| Chemical Name | 1-(1-Naphthylmethyl)-1h-pyrazol-5-amine |
| IUPAC Name | 2-(naphthalen-1-ylmethyl)pyrazol-3-amine |
| InChI | InChI=1S/C14H13N3/c15-14-8-9-16-17(14)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10,15H2 |
| InChI Key | XDFCSRDDAZVANV-UHFFFAOYSA-N |
| MDL Number | MFCD09740022 |
| Molecular Formula | C14H13N3 |
| Molecular Weight | 223.2731 |
| SMILES | NC1N(CC2=C3C(C=CC=C3)=CC=C2)N=CC=1 |
| Synonyms | 1-(naphthalen-1-ylmethyl)-1H-pyrazol-5-amine,
1-(1-naphthylmethyl)-1H-pyrazol-5-amine,
75427-10-0,
AC1Q52C3,
CTK7E0281,
ZINC19689491,
AKOS000147423,
MCULE-9517982673,
NE24594,
EN300-41234,
AB01002146-01,
|
| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.279g/mol |
| Monoisotopic Mass | 223.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number