(2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]

C11H16O5 — CID 135068915

IUPAC(2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]
SMILESCO[C@@H]1O[C@]2(CC=CO2)C2OC(C)(C)OC21
InChIInChI=1S/C11H16O5/c1-10(2)14-7-8(15-10)11(5-4-6-13-11)16-9(7)12-3/h4,6-9H,5H2,1-3H3/t7?,8?,9-,11-/m1/s1
InChIKeyLFEUQONWRMALAQ-RSWAIMACSA-N
MW228.24 g/mol
LogP1.14
Rot. Bonds1

About (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]

(2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole] (PubChem CID 135068915) has the molecular formula C11H16O5 and a molecular weight of 228.24 g/mol. Its IUPAC name is (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole].

Molecular Properties

Compound Name(2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]
PubChem CID135068915
Molecular FormulaC11H16O5
Molecular Weight228.24 g/mol
Exact Mass228.10
IUPAC Name(2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]
SMILESCO[C@@H]1O[C@]2(CC=CO2)C2OC(C)(C)OC21
InChIInChI=1S/C11H16O5/c1-10(2)14-7-8(15-10)11(5-4-6-13-11)16-9(7)12-3/h4,6-9H,5H2,1-3H3/t7?,8?,9-,11-/m1/s1
InChIKeyLFEUQONWRMALAQ-RSWAIMACSA-N
XLogP1.14
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.24
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole] with MolForge

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Related Compounds

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5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-6-[(E)-prop-1-enoxy]-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole
CID 6392479
5-Ethenyl-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole
CID 18534362
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CID 72723979
(3aS,4S,6R,6aS)-6-ethenyl-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole
CID 101003429
(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-6-prop-2-enyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole
CID 138977914
(3aR,5R,6S,6aR)-5-(3,3-difluoroprop-2-enyl)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole
CID 21578426
(3aR,5R,6R,6aR)-5-(3,3-difluoroprop-2-enyl)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole
CID 21578428
(1S,2R,6R,8R)-4,4-dimethyl-3,5,7,11-tetraoxatricyclo[6.3.0.02,6]undec-9-ene
CID 21585841
(3aR,6R,6aR)-6-ethenyl-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole
CID 10845709
(3aR,4R,6R,6aR)-6-ethenyl-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole
CID 11735792

Frequently Asked Questions

What is the IUPAC name of (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]?
The IUPAC name of (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole] (CID 135068915) is (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole].
What is the SMILES notation for (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]?
The canonical SMILES for (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole] is CO[C@@H]1O[C@]2(CC=CO2)C2OC(C)(C)OC21.
What is the InChIKey of (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]?
The InChIKey is LFEUQONWRMALAQ-RSWAIMACSA-N. The full InChI is InChI=1S/C11H16O5/c1-10(2)14-7-8(15-10)11(5-4-6-13-11)16-9(7)12-3/h4,6-9H,5H2,1-3H3/t7?,8?,9-,11-/m1/s1.
What are the key properties of (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole]?
(2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole] has a molecular weight of 228.24 g/mol, XLogP of 1.14, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6'R)-6'-methoxy-2',2'-dimethylspiro[3H-furan-2,4'-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole] is sourced from PubChem (CID 135068915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).