| CAS Number | 37609-31-7 |
| Catalog Number | AG00I7EO(AGN-PC-0NJCDG) |
| Chemical Name | Spiro[3.4]octan-1-one |
| IUPAC Name | spiro[3.4]octan-3-one |
| InChI | InChI=1S/C8H12O/c9-7-3-6-8(7)4-1-2-5-8/h1-6H2 |
| InChI Key | SCXSEYWVNBAKBH-UHFFFAOYSA-N |
| MDL Number | MFCD18910992 |
| Molecular Formula | C8H12O |
| Molecular Weight | 124.1803 |
| SMILES | O=C1CCC12CCCC2 |
| Synonyms | SPIRO[3.4]OCTAN-1-ONE,
37609-31-7,
spirooctanone,
DTXSID10501891,
MFCD18910992,
ZINC95836095,
AKOS023808473,
NE22302,
AS-42430,
CS-0067367,
Z2327131609,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 124.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 124.183g/mol |
| Monoisotopic Mass | 124.089g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number