| CAS Number | 25308-67-2 |
| Catalog Number | AG00IL6V(AGN-PC-0NHYHG) |
| Chemical Name | Spiro[2.5]octan-5-one |
| IUPAC Name | spiro[2.5]octan-7-one |
| InChI | InChI=1S/C8H12O/c9-7-2-1-3-8(6-7)4-5-8/h1-6H2 |
| InChI Key | QFRPTKNBKJSYAT-UHFFFAOYSA-N |
| MDL Number | MFCD22071548 |
| Molecular Formula | C8H12O |
| Molecular Weight | 124.1803 |
| SMILES | O=C1CCCC2(CC2)C1 |
| Synonyms | Spiro[2.5]octan-5-one,
25308-67-2,
Spiro[2.5]octane-5-one,
SCHEMBL1700931,
QFRPTKNBKJSYAT-UHFFFAOYSA-N,
MFCD22071548,
ZINC82411553,
AKOS017344730,
KS-0000085A,
AS-53932,
DA-43034,
CS-0048695,
FT-0765621,
F2147-8303,
|
| Complexity | 145 |
| 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 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number