| CAS Number | 1510992-29-6 |
| Catalog Number | AG00IM1J(AGN-PC-0WQUWG) |
| Chemical Name | 1-(tert-Butyl)cyclobutanecarboxylic acid |
| IUPAC Name | 1-tert-butylcyclobutane-1-carboxylic acid |
| InChI | InChI=1S/C9H16O2/c1-8(2,3)9(7(10)11)5-4-6-9/h4-6H2,1-3H3,(H,10,11) |
| InChI Key | CZLFDPZHKQNBLJ-UHFFFAOYSA-N |
| MDL Number | MFCD31617044 |
| Molecular Formula | C9H16O2 |
| Molecular Weight | 156.2221 |
| SMILES | CC(C1(C(O)=O)CCC1)(C)C |
| Synonyms | 1-(tert-Butyl)cyclobutanecarboxylicacid,
1510992-29-6,
SCHEMBL1091337,
CS-B1747,
AKOS022905649,
1-tert-butylcyclobutane-1-carboxylic acid,
CS-13467,
Cyclobutanecarboxylic acid, 1-(1,1-dimethylethyl)-,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.225g/mol |
| Monoisotopic Mass | 156.115g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number