1-(2-Azidoethyl)decahydrobenzo[e][1,4]oxazepine - CAS 2098116-04-0
Catalog: |
BB075631 |
Product Name: |
1-(2-Azidoethyl)decahydrobenzo[e][1,4]oxazepine |
CAS: |
2098116-04-0 |
Synonyms: |
1-(2-azidoethyl)decahydrobenzo[e][1,4]oxazepine; 1-(2-azidoethyl)-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[e][1,4]oxazepine |
IUPAC Name: | 1-(2-azidoethyl)-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[e][1,4]oxazepine |
Description: | 1-(2-Azidoethyl)decahydrobenzo[e][1,4]oxazepine is a useful research chemical compound. |
Molecular Weight: | 224.3 |
Molecular Formula: | C11H20N4O |
Canonical SMILES: | C1CCC2C(C1)COCCN2CCN=[N+]=[N-] |
InChI: | InChI=1S/C11H20N4O/c12-14-13-5-6-15-7-8-16-9-10-3-1-2-4-11(10)15/h10-11H,1-9H2 |
InChI Key: | UIQDPOWBXNVVBH-UHFFFAOYSA-N |
Complexity: | 265 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.16371127 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.16371127 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.8Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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