| CAS Number | 93628-01-4 |
| Catalog Number | AG00GR7O(AGN-PC-0W388P) |
| Chemical Name | ACETONE (13C3) |
| IUPAC Name | (1,2,3-13C3)propan-2-one |
| InChI | InChI=1S/C3H6O/c1-3(2)4/h1-2H3/i1+1,2+1,3+1 |
| InChI Key | CSCPPACGZOOCGX-VMIGTVKRSA-N |
| MDL Number | MFCD00083865 |
| Molecular Formula | C3H6O |
| Molecular Weight | 61.0571 |
| SMILES | [13CH3][13C](=O)[13CH3] |
| Synonyms | Acetone-13C3,
93628-01-4,
(13C3)Acetone,
DTXSID30465668,
Acetone-13C3, 99 atom % 13C,
Chevron acetone,
propan-2-one,
CID11434908,
|
| Complexity | 26.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 61.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 4 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 3 |
| Molecular Weight | 61.057g/mol |
| Monoisotopic Mass | 61.052g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number