| CAS Number | 87976-71-4 |
| Catalog Number | AG003UDX(AGN-PC-0VI0V0) |
| Chemical Name | Pyruvic acid-13C-2 (sodium) |
| IUPAC Name | sodium;2-oxo(113C)propanoate |
| InChI | InChI=1S/C3H4O3.Na/c1-2(4)3(5)6;/h1H3,(H,5,6);/q;+1/p-1/i3+1; |
| InChI Key | DAEPDZWVDSPTHF-FJUFCODESA-M |
| MDL Number | MFCD00084079 |
| Molecular Formula | C3H3NaO3 |
| Molecular Weight | 111.0365 |
| SMILES | [13C](C(=O)C)(=O)[O-].[Na+] |
| Synonyms | Sodium pyruvate-1-13C,
Sodium pyruvate-3-13C,
87976-71-4,
SCHEMBL1333219,
CTK8G3159,
DTXSID40635577,
Pyruvic acid-1-13C sodium salt,
Sodium 2-oxo(1-~13~C)propanoate,
AKOS015913330,
Sodium pyruvate-1-13C, 99 atom % 13C,
J-005036,
I14-45383,
SODIUM PYRUVATE,
Sodium Pyruvate 1-13C,
PYRUVICACID,SODIUMSALT,
CS-BE-00043,
CID11571791,
124052-04-6,
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| Complexity | 88.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 111.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 1 |
| Molecular Weight | 111.036g/mol |
| Monoisotopic Mass | 111.001g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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