4-Azaspiro[bicyclo[2.2.2]octane-2,2'-oxirane] - CAS 41353-91-7
Catalog: |
BB074317 |
Product Name: |
4-Azaspiro[bicyclo[2.2.2]octane-2,2'-oxirane] |
CAS: |
41353-91-7 |
Synonyms: |
Spiro[1-azabicyclo[2.2.2]octane-3,2'-oxirane]; 1'-Azaspiro[oxirane-2,3'-bicyclo[2.2.2]octane]; 4-AZASPIRO[BICYCLO[2.2.2]OCTANE-2,2'-OXIRANE]; spiro[4-azabicyclo[2.2.2]octane-2,2'-oxirane] |
IUPAC Name: | spiro[1-azabicyclo[2.2.2]octane-3,2'-oxirane] |
Molecular Weight: | 139.19 |
Molecular Formula: | C8H13NO |
Canonical SMILES: | C1CN2CCC1C3(C2)CO3 |
InChI: | InChI=1S/C8H13NO/c1-3-9-4-2-7(1)8(5-9)6-10-8/h7H,1-6H2 |
InChI Key: | TYCHQBRUARUTCL-UHFFFAOYSA-N |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.099714038 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 15.8Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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