| CAS Number | 77211-58-6 |
| Catalog Number | AG00GGLJ(AGN-PC-0WAZNJ) |
| Chemical Name | 3-Phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one |
| IUPAC Name | 3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one |
| InChI | InChI=1S/C13H16N2O2/c16-12-15(11-4-2-1-3-5-11)10-13(17-12)6-8-14-9-7-13/h1-5,14H,6-10H2 |
| InChI Key | ZBIRMOGNCYIDGT-UHFFFAOYSA-N |
| MDL Number | MFCD19982780 |
| Molecular Formula | C13H16N2O2 |
| Molecular Weight | 232.2783 |
| SMILES | O=C1N(C2=CC=CC=C2)CC2(CCNCC2)O1 |
| Synonyms | 3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one,
77211-58-6,
SCHEMBL737322,
ZBIRMOGNCYIDGT-UHFFFAOYSA-N,
9531AE,
ZINC59683241,
AKOS015991434,
GF-0106,
MCULE-4435828147,
KS-000025I3,
CS-0090657,
phenyloxadiazaspirodecanone,
C13H16N2O2,
RP13355,
|
| Complexity | 294 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.121178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.28g/mol |
| Monoisotopic Mass | 232.121178g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number