(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol

C7H14O3 — CID 144869586

IUPAC(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol
SMILESC1C[C@H]2OCC[C@H]2O1.CO
InChIInChI=1S/C6H10O2.CH4O/c1-3-7-6-2-4-8-5(1)6;1-2/h5-6H,1-4H2;2H,1H3/t5-,6-;/m1./s1
InChIKeyMBUGLQXHZZFLFB-KGZKBUQUSA-N
MW146.19 g/mol
LogP0.17
Rot. Bonds

About (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol

(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol (PubChem CID 144869586) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol.

Molecular Properties

Compound Name(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol
PubChem CID144869586
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol
SMILESC1C[C@H]2OCC[C@H]2O1.CO
InChIInChI=1S/C6H10O2.CH4O/c1-3-7-6-2-4-8-5(1)6;1-2/h5-6H,1-4H2;2H,1H3/t5-,6-;/m1./s1
InChIKeyMBUGLQXHZZFLFB-KGZKBUQUSA-N
XLogP0.17
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6aS)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 90136279
(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;ethane;methoxy thiohypoiodite
CID 143993341
2-cyclopropyloxetane
CID 102488279
4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran
CID 146474205
2,3,3a,4,5,7,8,8a-octahydrofuro[2,3-d]oxepine
CID 118209812
oxetan-2-ol
CID 175273147
2,6,13,17-tetraoxatricyclo[16.4.0.07,12]docosane
CID 23848053
2-(4-methylcyclohexyl)oxetane
CID 59188362
(5R)-2,6-dioxabicyclo[3.1.0]hexane
CID 174637140
2-(oxiran-2-yl)oxolane
CID 18759351
methanol;(2S,3R)-2,3,4-trimethyloxane
CID 145399685
(2S)-2-[(2S)-oxetan-2-yl]morpholine
CID 86311966

Frequently Asked Questions

What is the IUPAC name of (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol?
The IUPAC name of (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol (CID 144869586) is (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol.
What is the SMILES notation for (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol?
The canonical SMILES for (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol is C1C[C@H]2OCC[C@H]2O1.CO.
What is the InChIKey of (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol?
The InChIKey is MBUGLQXHZZFLFB-KGZKBUQUSA-N. The full InChI is InChI=1S/C6H10O2.CH4O/c1-3-7-6-2-4-8-5(1)6;1-2/h5-6H,1-4H2;2H,1H3/t5-,6-;/m1./s1.
What are the key properties of (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol?
(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol has a molecular weight of 146.19 g/mol, XLogP of 0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;methanol is sourced from PubChem (CID 144869586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).