| CAS Number | 874196-88-0 |
| Catalog Number | AG00IEIL(AGN-PC-0BGVJT) |
| Chemical Name | Ethyl 1-(2-morpholinoethyl)-1H-pyrazole-4-carboxylate |
| IUPAC Name | ethyl 1-(2-morpholin-4-ylethyl)pyrazole-4-carboxylate |
| InChI | InChI=1S/C12H19N3O3/c1-2-18-12(16)11-9-13-15(10-11)4-3-14-5-7-17-8-6-14/h9-10H,2-8H2,1H3 |
| InChI Key | GQLRHCUGMOZGHG-UHFFFAOYSA-N |
| MDL Number | MFCD23158918 |
| Molecular Formula | C12H19N3O3 |
| Molecular Weight | 253.2976 |
| SMILES | CCOC(=O)c1cnn(CCN2CCOCC2)c1 |
| Synonyms | 874196-88-0,
Ethyl 1-(2-morpholinoethyl)-1H-pyrazole-4-carboxylate,
SCHEMBL2825278,
MFCD23158918,
ZINC71921378,
AKOS017518689,
MCULE-2757990815,
Z1255593759,
ethyl 1-[2-(morpholin-4-yl)ethyl]-1H-pyrazole-4-carboxylate,
ethyl 1-(2-morpholin-4-ylethyl)pyrazole-4-carboxylate,
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| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.302g/mol |
| Monoisotopic Mass | 253.143g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 56.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number