(6R)-5-Azaspiro[2.4]heptane-5,6-dicarboxylic Acid 5-(1,1-dimethylethyl) Ester - CAS 1454843-78-7
Catalog: |
BB074273 |
Product Name: |
(6R)-5-Azaspiro[2.4]heptane-5,6-dicarboxylic Acid 5-(1,1-dimethylethyl) Ester |
CAS: |
1454843-78-7 |
Synonyms: |
(R)-5-(TERT-BUTOXYCARBONYL)-5-AZASPIRO[2.4]HEPTANE-6-CARBOXYLIC ACID; (R)-5-BOC-5-AZASPIRO[2.4]HEPTANE-6-CARBOXYLIC ACID; (6R)-5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid; 5-Azaspiro[2.4]heptane-5,6-dicarboxylic acid, 5-(1,1-dimethylethyl) ester, (6R)-; (6R)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid |
IUPAC Name: | (6R)-5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid |
Description: | (6R)-5-Azaspiro[2.4]heptane-5,6-dicarboxylic Acid 5-(1,1-dimethylethyl) Ester can be used as reactant/reagent in synthetic preparation of optically active proline analogs. |
Molecular Weight: | 241.28 |
Molecular Formula: | C12H19NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC2(CC2)CC1C(=O)O |
InChI: | InChI=1S/C12H19NO4/c1-11(2,3)17-10(16)13-7-12(4-5-12)6-8(13)9(14)15/h8H,4-7H2,1-3H3,(H,14,15)/t8-/m1/s1 |
InChI Key: | VEIYKHIPSJIVRK-MRVPVSSYSA-N |
Complexity: | 354 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.13140809 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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