(2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone

C12H20O6 — CID 11276964

IUPAC(2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone
SMILESCC1(C)OC[C@H](C(=O)[C@H](O)[C@H]2COC(C)(C)O2)O1
InChIInChI=1S/C12H20O6/c1-11(2)15-5-7(17-11)9(13)10(14)8-6-16-12(3,4)18-8/h7-9,13H,5-6H2,1-4H3/t7-,8-,9-/m1/s1
InChIKeyMBGFNUOFBSBKDD-IWSPIJDZSA-N
MW260.29 g/mol
LogP0.22
Rot. Bonds3

About (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone

(2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone (PubChem CID 11276964) has the molecular formula C12H20O6 and a molecular weight of 260.29 g/mol. Its IUPAC name is (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone.

Molecular Properties

Compound Name(2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone
PubChem CID11276964
Molecular FormulaC12H20O6
Molecular Weight260.29 g/mol
Exact Mass260.13
IUPAC Name(2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone
SMILESCC1(C)OC[C@H](C(=O)[C@H](O)[C@H]2COC(C)(C)O2)O1
InChIInChI=1S/C12H20O6/c1-11(2)15-5-7(17-11)9(13)10(14)8-6-16-12(3,4)18-8/h7-9,13H,5-6H2,1-4H3/t7-,8-,9-/m1/s1
InChIKeyMBGFNUOFBSBKDD-IWSPIJDZSA-N
XLogP0.22
TPSA74.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone?
The IUPAC name of (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone (CID 11276964) is (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone.
What is the SMILES notation for (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone?
The canonical SMILES for (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone is CC1(C)OC[C@H](C(=O)[C@H](O)[C@H]2COC(C)(C)O2)O1.
What is the InChIKey of (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone?
The InChIKey is MBGFNUOFBSBKDD-IWSPIJDZSA-N. The full InChI is InChI=1S/C12H20O6/c1-11(2)15-5-7(17-11)9(13)10(14)8-6-16-12(3,4)18-8/h7-9,13H,5-6H2,1-4H3/t7-,8-,9-/m1/s1.
What are the key properties of (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone?
(2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone has a molecular weight of 260.29 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxyethanone is sourced from PubChem (CID 11276964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).