cis-2,3,3a,6a-Tetrahydro-furo[2,3-b]furan - CAS 109789-21-1
Catalog: |
BB076745 |
Product Name: |
cis-2,3,3a,6a-Tetrahydro-furo[2,3-b]furan |
CAS: |
109789-21-1 |
Synonyms: |
(3aR,6aS)-rel-2,3,3a,6a-Tetrahydro-furo[2,3-b]furan |
IUPAC Name: | (3aS,6aR)-2,3,3a,6a-tetrahydrofuro[2,3-b]furan |
Description: | cis-2,3,3a,6a-Tetrahydro-furo[2,3-b]furan is potentially used in the formal synthesis of Aflatoxin B2. |
Molecular Weight: | 112.13 |
Molecular Formula: | C6H8O2 |
Canonical SMILES: | C1COC2C1C=CO2 |
InChI: | InChI=1S/C6H8O2/c1-3-7-6-5(1)2-4-8-6/h1,3,5-6H,2,4H2/t5-,6+/m1/s1 |
InChI Key: | YJHXIHVWEGRVLQ-RITPCOANSA-N |
References: | Eastham, Stephen A., et al. Tetrahedron, 64 (5), 936-948 (2007); Eastham, Stephen A., et al. Tetrahedron Lett., 47(14), 2299-2304 (2006). |
Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 112.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 112.052429494 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 18.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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