| CAS Number | 1314390-66-3 |
| Catalog Number | AG00HSGR(AGN-PC-0WR36B) |
| Chemical Name | Spiro[2.5]octane-5-carboxylic Acid |
| IUPAC Name | spiro[2.5]octane-7-carboxylic acid |
| InChI | InChI=1S/C9H14O2/c10-8(11)7-2-1-3-9(6-7)4-5-9/h7H,1-6H2,(H,10,11) |
| InChI Key | ZOQQTCPUNHQTIR-UHFFFAOYSA-N |
| MDL Number | MFCD20230621 |
| Molecular Formula | C9H14O2 |
| Molecular Weight | 154.2063 |
| SMILES | C1CC(CC2(C1)CC2)C(=O)O |
| Synonyms | spiro[2.5]octane-5-carboxylic acid,
1314390-66-3,
AM806368,
DA-46102,
CS-0058275,
FT-0712667,
spiro[2.5]?octane-?5-?carboxylic acid,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.209g/mol |
| Monoisotopic Mass | 154.099g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number