| CAS Number | 108395-15-9 |
| Catalog Number | AG008VVM(AGN-PC-0WH3CE) |
| Chemical Name | 2-Ketoglutaric acid-13C |
| IUPAC Name | 2-oxo(113C)pentanedioic acid |
| InChI | InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)/i5+1 |
| InChI Key | KPGXRSRHYNQIFN-HOSYLAQJSA-N |
| Molecular Formula | C5H6O5 |
| Molecular Weight | 147.0908 |
| SMILES | C(=O)([13C](=O)O)CCC(=O)O |
| Synonyms | 2-Ketoglutaric Acid-13C1,
108395-15-9,
2-Ketoglutaric acid-1-13C,
2-Oxopentanedioic Acid-13C1,
2-Oxopentanedioic acid-1-13C,
2-Ketopentanedioic acid-1-13C,
SCHEMBL17127347,
DTXSID90439522,
FT-0670633,
2-Ketoglutaric acid-1-13C, 99 atom % 13C, 95% (CP),
2-Oxopentanedioic acid,
2-Ketoglutaric Acid 13C1,
alpha-Ketoglutaric acid alpha,
CS-T-57005,
CID10419327,
|
| Complexity | 171 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 1 |
| Molecular Weight | 147.09g/mol |
| Monoisotopic Mass | 147.025g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 91.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number