(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane

C19H20O4 — CID 11716583

IUPAC(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane
SMILESC=C1CO[C@H](c2ccc(OC)cc2)[C@@H](c2ccc(OC)cc2)O1
InChIInChI=1S/C19H20O4/c1-13-12-22-18(14-4-8-16(20-2)9-5-14)19(23-13)15-6-10-17(21-3)11-7-15/h4-11,18-19H,1,12H2,2-3H3/t18-,19-/m1/s1
InChIKeyOUNGIWSBIIYCPR-RTBURBONSA-N
MW312.37 g/mol
LogP4.05
Rot. Bonds4

About (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane

(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane (PubChem CID 11716583) has the molecular formula C19H20O4 and a molecular weight of 312.37 g/mol. Its IUPAC name is (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane.

Molecular Properties

Compound Name(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane
PubChem CID11716583
Molecular FormulaC19H20O4
Molecular Weight312.37 g/mol
Exact Mass312.14
IUPAC Name(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane
SMILESC=C1CO[C@H](c2ccc(OC)cc2)[C@@H](c2ccc(OC)cc2)O1
InChIInChI=1S/C19H20O4/c1-13-12-22-18(14-4-8-16(20-2)9-5-14)19(23-13)15-6-10-17(21-3)11-7-15/h4-11,18-19H,1,12H2,2-3H3/t18-,19-/m1/s1
InChIKeyOUNGIWSBIIYCPR-RTBURBONSA-N
XLogP4.05
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenyl)-5-methylidene-1,3-dioxane
CID 18704700
(4S,5S)-5-(4-methoxyphenyl)-4-methyl-3-methylideneoxolan-2-one
CID 101402507
(2R,3S)-2-(4-methoxyphenyl)-4-methylidene-3-(prop-2-enoxymethyl)oxolane
CID 11521764
(2R,3R)-2-(4-methoxyphenyl)-4-methylidene-5-oxooxolane-3-carboxylic acid
CID 102094067
(2R,3R)-2-bromo-3-(4-methoxyphenyl)-1,4-dioxane
CID 162408429
2,5-bis(4-methoxyphenyl)-3,4-dimethyloxolane
CID 14681590
4-(4-methoxyphenyl)-2-methylideneoxolane
CID 102089342
(2S,3S)-2-(4-chlorophenyl)-3-(4-methoxyphenyl)oxirane
CID 101333877
2-(4-methoxyphenyl)oxolane-3-carbaldehyde
CID 2763136
4-methoxy-2-(4-methoxyphenyl)-2H-chromene
CID 154356806
(2R,3R)-2-cyclohexyl-3-(4-methoxyphenyl)oxirane
CID 11207019
(2R,3S)-3-(4-methoxyphenyl)-N-methyloxirane-2-carboxamide
CID 57212777

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane?
The IUPAC name of (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane (CID 11716583) is (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane.
What is the SMILES notation for (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane?
The canonical SMILES for (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane is C=C1CO[C@H](c2ccc(OC)cc2)[C@@H](c2ccc(OC)cc2)O1.
What is the InChIKey of (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane?
The InChIKey is OUNGIWSBIIYCPR-RTBURBONSA-N. The full InChI is InChI=1S/C19H20O4/c1-13-12-22-18(14-4-8-16(20-2)9-5-14)19(23-13)15-6-10-17(21-3)11-7-15/h4-11,18-19H,1,12H2,2-3H3/t18-,19-/m1/s1.
What are the key properties of (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane?
(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane has a molecular weight of 312.37 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane is sourced from PubChem (CID 11716583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).