2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen

C13H24O7 — CID 171620812

IUPAC2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen
SMILESCOCC1OCC(C2OC3OC(COC)OC3C2C)O1.[H][H]
InChIInChI=1S/C13H22O7.H2/c1-7-11(8-4-16-9(17-8)5-14-2)20-13-12(7)18-10(19-13)6-15-3;/h7-13H,4-6H2,1-3H3;1H
InChIKeyYBVHSOPBPMWDNT-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.37
Rot. Bonds5

About 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen

2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen (PubChem CID 171620812) has the molecular formula C13H24O7 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen.

Molecular Properties

Compound Name2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen
PubChem CID171620812
Molecular FormulaC13H24O7
Molecular Weight292.33 g/mol
Exact Mass292.15
IUPAC Name2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen
SMILESCOCC1OCC(C2OC3OC(COC)OC3C2C)O1.[H][H]
InChIInChI=1S/C13H22O7.H2/c1-7-11(8-4-16-9(17-8)5-14-2)20-13-12(7)18-10(19-13)6-15-3;/h7-13H,4-6H2,1-3H3;1H
InChIKeyYBVHSOPBPMWDNT-UHFFFAOYSA-N
XLogP0.37
TPSA64.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen with MolForge

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Related Compounds

2-(methoxymethyl)-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]dioxine-6,7-diol
CID 171620819
4,11-diethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane
CID 176842545
2,4,6-tris(methoxymethyl)-1,3,5-trioxane
CID 163692364
CID 59269207
CID 59269207
(3aS,5R,6R,7S,7aS)-6,7-dimethoxy-5-(methoxymethyl)-2-methyl-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyran
CID 102504527
2-(methoxymethyl)-5-propan-2-yl-1,3-dioxane
CID 89076520
O-[(4-methyl-1,3-dioxolan-2-yl)methyl]hydroxylamine
CID 134925790
(1R,3R,6R,8S,11R,13R,16R,18R,21R,23R,26R,28R,31R,33R,36S,38S,40S,42S,44S,46S,48S)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecamethoxy-5,10,15,20,25,30,35-heptakis(methoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane
CID 133126616
(1R,3R,4R,6R,8R,9R,11R,13R,14S,15R,16R,18R,19R,21R,23R,24R,26R,28R,29S,30R,32R,41R,43R,44S,45R,46S,47R,48S,49R,50S)-14,15,29,30,43,44,45,46,47,48,49,50-dodecamethoxy-4,9,19,24-tetrakis(methoxymethyl)-2,5,7,10,12,17,20,22,25,27,31,34,39,42-tetradecaoxaoctacyclo[14.14.12.23,6.28,11.218,21.223,26.013,41.028,32]pentacontane
CID 25228966
(2S,4R)-2-(methoxymethyl)-4-methyloxolane
CID 146559112
(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36S,37R,38S,39R,40S,41R,42S,43R,44S,45R,46R,47R,48S,49R)-37,39,41,43,45,47,49-heptamethoxy-5,10,15,20,25,30,35-heptakis(methoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,38,40,42,44,46,48-heptol
CID 15973770
(2R,4aR,6S,7R,8R,8aS)-2,6,7,8-tetramethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
CID 58743215

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen?
The IUPAC name of 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen (CID 171620812) is 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen.
What is the SMILES notation for 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen?
The canonical SMILES for 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen is COCC1OCC(C2OC3OC(COC)OC3C2C)O1.[H][H].
What is the InChIKey of 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen?
The InChIKey is YBVHSOPBPMWDNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O7.H2/c1-7-11(8-4-16-9(17-8)5-14-2)20-13-12(7)18-10(19-13)6-15-3;/h7-13H,4-6H2,1-3H3;1H.
What are the key properties of 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen?
2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen has a molecular weight of 292.33 g/mol, XLogP of 0.37, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-[2-(methoxymethyl)-1,3-dioxolan-4-yl]-6-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole;molecular hydrogen is sourced from PubChem (CID 171620812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).