1-(1,4-Dioxaspiro[4.5]dec-8-yl)pyrrolidine - CAS 72714-97-7
Catalog: |
BB055933 |
Product Name: |
1-(1,4-Dioxaspiro[4.5]dec-8-yl)pyrrolidine |
CAS: |
72714-97-7 |
Synonyms: |
1,4-Dioxaspiro[4.5]decane Pyrrolidine Derivative |
IUPAC Name: | 1-(1,4-dioxaspiro[4.5]decan-8-yl)pyrrolidine |
Description: | 1-(1,4-Dioxaspiro[4.5]dec-8-yl)pyrrolidine is an intermediate in synthesizing 1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl)pyrrolidine (T302640). It is an analogue of 5-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-2-en-1-one (M330210), a reactant used in the preparation of kinase inhibitors. |
Molecular Weight: | 211.31 |
Molecular Formula: | C12H21NO2 |
Canonical SMILES: | C1CCN(C1)C2CCC3(CC2)OCCO3 |
InChI: | InChI=1S/C12H21NO2/c1-2-8-13(7-1)11-3-5-12(6-4-11)14-9-10-15-12/h11H,1-10H2 |
InChI Key: | RMWCZBNBDOEHQY-UHFFFAOYSA-N |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.157228913 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.157228913 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 21.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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