| CAS Number | 914780-95-3 |
| Catalog Number | AG018RSE(AGN-PC-0WBPQN) |
| Chemical Name | 1,4-dioxa-10-azadispiro[4.2.4^{8}.2^{5}]tetradecan-11-one |
| IUPAC Name | 9,12-dioxa-3-azadispiro[4.2.48.25]tetradecan-2-one |
| InChI | InChI=1S/C11H17NO3/c13-9-7-10(8-12-9)1-3-11(4-2-10)14-5-6-15-11/h1-8H2,(H,12,13) |
| InChI Key | NUPNYQFGLIQQGM-UHFFFAOYSA-N |
| MDL Number | MFCD24566289 |
| Molecular Formula | C11H17NO3 |
| Molecular Weight | 211.2576 |
| SMILES | O=C(C1)NCC1(CC2)CCC32OCCO3 |
| Synonyms | 914780-95-3,
1,4-dioxa-10-aza-dispiro[4.2.4.2]tetradecan-11-one,
1,4-Dioxa-10-azadispiro[4.2.4.2]tetradecan-11-one,
1,4-dioxa-10-azadispiro[4.2.4?.2?]tetradecan-11-one,
SCHEMBL2106275,
NUPNYQFGLIQQGM-UHFFFAOYSA-N,
MFCD24566289,
AKOS026676539,
ZINC118042791,
CS-0046825,
F8880-1431,
Z1954803374,
1,4-Dioxa-10-azadispiro[4.2.48.25]tetradecan-11-one,
1,4-dioxa-10-azadispiro[4.2.4^{8}.2^{5}]tetradecan-11-one,
|
| Complexity | 274 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.261g/mol |
| Monoisotopic Mass | 211.121g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number