| CAS Number | 332404-11-2 |
| Catalog Number | AG00CLV9(AGN-PC-0LDAKM) |
| Chemical Name | 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carbohydrazide |
| IUPAC Name | 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carbohydrazide |
| InChI | InChI=1S/C12H15N3O3/c1-18-10-4-2-9(3-5-10)15-7-8(6-11(15)16)12(17)14-13/h2-5,8H,6-7,13H2,1H3,(H,14,17) |
| InChI Key | FFXTXEFSJTTWTM-UHFFFAOYSA-N |
| MDL Number | MFCD01002230 |
| Molecular Formula | C12H15N3O3 |
| Molecular Weight | 249.2658 |
| SMILES | O=C1CC(C(NN)=O)CN1C1C=CC(=CC=1)OC |
| Synonyms | 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carbohydrazide,
332404-11-2,
AC1NCNDR,
Oprea1_287962,
ALBB-016388,
BBL008656,
HTS015088,
MFCD01002230,
STK080621,
AKOS000339437,
AKOS016042540,
MCULE-4933906569,
K-7672,
3-Pyrrolidinecarboxylic acid, 1-(4-methoxyphenyl)-5-oxo-, hydrazide,
C12H15N3O3,
ZINC04671697,
CID4561657,
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| Complexity | 327 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.27g/mol |
| Monoisotopic Mass | 249.111g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 84.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number