| CAS Number | 1638767-27-7 |
| Catalog Number | AG01ALEW(AGN-PC-0WAK93) |
| Chemical Name | 2-(3,3-dimethylcyclobutyl)acetic acid |
| IUPAC Name | 2-(3,3-dimethylcyclobutyl)acetic acid |
| InChI | InChI=1S/C8H14O2/c1-8(2)4-6(5-8)3-7(9)10/h6H,3-5H2,1-2H3,(H,9,10) |
| InChI Key | CSWFRCFXIHKGAF-UHFFFAOYSA-N |
| MDL Number | MFCD26938296 |
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.1956 |
| SMILES | CC1(CC(CC(O)=O)C1)C |
| Synonyms | 2-(3,3-dimethylcyclobutyl)acetic acid,
1638767-27-7,
2-(3,3-dimethylcyclobutyl)aceticacid,
SCHEMBL17709929,
CSWFRCFXIHKGAF-UHFFFAOYSA-N,
AKOS028113529,
ZINC238188255,
CS-0056106,
Z2213892991,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.198g/mol |
| Monoisotopic Mass | 142.099g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number