| CAS Number | 257885-34-0 |
| Catalog Number | AG00I4X7(AGN-PC-0WC0IW) |
| Chemical Name | 4-(2-Acetylhydrazino)-4-oxobutanoic acid |
| IUPAC Name | 4-(2-acetylhydrazinyl)-4-oxobutanoic acid |
| InChI | InChI=1S/C6H10N2O4/c1-4(9)7-8-5(10)2-3-6(11)12/h2-3H2,1H3,(H,7,9)(H,8,10)(H,11,12) |
| InChI Key | BRNXPLBEBZMDFV-UHFFFAOYSA-N |
| MDL Number | MFCD11696373 |
| Molecular Formula | C6H10N2O4 |
| Molecular Weight | 174.1546 |
| SMILES | C(CCC(O)=O)(=O)NNC(C)=O |
| Synonyms | 4-(2-acetylhydrazino)-4-oxobutanoic acid,
257885-34-0,
4-(2-acetylhydrazinyl)-4-oxobutanoic acid,
CTK7G8519,
ALBB-003812,
ZX-AN003785,
MFCD11696373,
STK502715,
ZINC25489631,
AKOS000369804,
MCULE-6110144216,
4-ACETOHYDRAZIDO-4-OXOBUTANOIC ACID,
TR-057795,
3-(N'-acetylhydrazinecarbonyl)propanoic acid,
BB 0240392,
3-(N'-Acetyl-hydrazinocarbonyl)propanoic acid,
4-(N'-Acetyl-hydrazino)-4-oxo-butyric acid,
T1654,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.156g/mol |
| Monoisotopic Mass | 174.064g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 95.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number