| CAS Number | 1349708-97-9 |
| Catalog Number | AG00HTT2(AGN-PC-0WA71W) |
| Chemical Name | 2-OXETAN-3-YL-2H-PYRAZOL-3-YLAMINE |
| IUPAC Name | 2-(oxetan-3-yl)pyrazol-3-amine |
| InChI | InChI=1S/C6H9N3O/c7-6-1-2-8-9(6)5-3-10-4-5/h1-2,5H,3-4,7H2 |
| InChI Key | XKHSVLAFKPJITN-UHFFFAOYSA-N |
| MDL Number | MFCD20233066 |
| Molecular Formula | C6H9N3O |
| Molecular Weight | 139.1552 |
| SMILES | NC1N(C2COC2)N=CC=1 |
| Synonyms | 1-(oxetan-3-yl)-1H-pyrazol-5-amine,
1349708-97-9,
2-Oxetan-3-yl-2H-pyrazol-3-ylamine,
KS-000007TU,
MFCD20233066,
ZINC23905325,
AS-34828,
CS-0052817,
1-?(3-?oxetanyl)?-1H-?pyrazol-?5-?amine,
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| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.158g/mol |
| Monoisotopic Mass | 139.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 53.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
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Certificate of Analysis
Lot Number