| CAS Number | 91968-35-3 |
| Catalog Number | AG01E2T6 |
| Chemical Name | Dispiro[3.1.3(6).1(4)]Decane-2-carboxylic acid |
| IUPAC Name | dispiro[3.1.36.14]decane-8-carboxylic acid |
| InChI | InChI=1S/C11H16O2/c12-9(13)8-4-11(5-8)6-10(7-11)2-1-3-10/h8H,1-7H2,(H,12,13) |
| InChI Key | CVKCBSAWXUGYTK-UHFFFAOYSA-N |
| MDL Number | MFCD20643814 |
| Molecular Formula | C11H16O2 |
| Molecular Weight | 180.2435 |
| SMILES | OC(=O)C1CC2(C1)CC3(CCC3)C2 |
| Synonyms | dispiro[3.1.3(6).1(4)]decane-2-carboxylic acid,
AKOS026715805,
ZINC238687415,
91968-35-3,
dispiro[3.1.3^{6}.1^{4}]decane-2-carboxylic acid,
F2147-2378,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.247g/mol |
| Monoisotopic Mass | 180.115g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number