| CAS Number | 1375963-52-2 |
| Catalog Number | AG01AKWF(AGN-PC-0WO6QA) |
| Chemical Name | 2-(1-methyl-1H-pyrazol-4-yl)morpholine |
| IUPAC Name | 2-(1-methylpyrazol-4-yl)morpholine |
| InChI | InChI=1S/C8H13N3O/c1-11-6-7(4-10-11)8-5-9-2-3-12-8/h4,6,8-9H,2-3,5H2,1H3 |
| InChI Key | KSBIDPYAPFHSRG-UHFFFAOYSA-N |
| MDL Number | MFCD22196666 |
| Molecular Formula | C8H13N3O |
| Molecular Weight | 167.2083 |
| SMILES | Cn1ncc(c1)C1CNCCO1 |
| Synonyms | 2-(1-methyl-1H-pyrazol-4-yl)morpholine,
1375963-52-2,
SCHEMBL19680559,
AKOS022907601,
NE47480,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.212g/mol |
| Monoisotopic Mass | 167.106g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
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Certificate of Analysis
Lot Number