| CAS Number | 3639-20-1 |
| Catalog Number | AG00CNGS(AGN-PC-0NGO2J) |
| Chemical Name | 2-hydroxy-2,3-dimethylbutanoic acid |
| IUPAC Name | 2-hydroxy-2,3-dimethylbutanoic acid |
| InChI | InChI=1S/C6H12O3/c1-4(2)6(3,9)5(7)8/h4,9H,1-3H3,(H,7,8) |
| InChI Key | JRQZJRDOZAJRTN-UHFFFAOYSA-N |
| MDL Number | MFCD16769962 |
| Molecular Formula | C6H12O3 |
| Molecular Weight | 132.1577 |
| SMILES | CC(C)C(C)(O)C(O)=O |
| Synonyms | 2-Hydroxy-2,3-dimethylbutanoic acid,
3639-20-1,
Butanoic acid, 2-hydroxy-2,3-dimethyl-,
SCHEMBL503261,
DTXSID70506029,
4613AB,
RW3345,
AKOS011777932,
MCULE-3909217790,
NE32841,
FT-0686257,
Z1868430559,
C6H12O3,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 132.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 132.159g/mol |
| Monoisotopic Mass | 132.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number