| CAS Number | 1314979-79-7 |
| Catalog Number | AG01C23W(AGN-PC-0WNQSL) |
| Chemical Name | 2-cyclobutyl-2-hydroxyacetic acid |
| IUPAC Name | 2-cyclobutyl-2-hydroxyacetic acid |
| InChI | InChI=1S/C6H10O3/c7-5(6(8)9)4-2-1-3-4/h4-5,7H,1-3H2,(H,8,9) |
| InChI Key | WDUASXFZWNGNDP-UHFFFAOYSA-N |
| MDL Number | MFCD19229710 |
| Molecular Formula | C6H10O3 |
| Molecular Weight | 130.1418 |
| SMILES | O=C(C(C1CCC1)O)O |
| Synonyms | 2-cyclobutyl-2-hydroxyacetic acid,
1314979-79-7,
(R)-2-Cyclobutyl-2-hydroxyacetic acid,
(S)-2-Cyclobutyl-2-hydroxyacetic acid,
2165929-78-0,
851866-88-1,
SCHEMBL5400030,
AKOS006378704,
SB22630,
Z2255110201,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.143g/mol |
| Monoisotopic Mass | 130.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number