(4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane

C11H14O2 — CID 11344328

IUPAC(4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane
SMILESCC1(C)OC[C@@H](c2ccccc2)O1
InChIInChI=1S/C11H14O2/c1-11(2)12-8-10(13-11)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3/t10-/m0/s1
InChIKeySFDXYHMRHIVYET-JTQLQIEISA-N
MW178.23 g/mol
LogP2.51
Rot. Bonds1

About (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane

(4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane (PubChem CID 11344328) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane.

Molecular Properties

Compound Name(4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane
PubChem CID11344328
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name(4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane
SMILESCC1(C)OC[C@@H](c2ccccc2)O1
InChIInChI=1S/C11H14O2/c1-11(2)12-8-10(13-11)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3/t10-/m0/s1
InChIKeySFDXYHMRHIVYET-JTQLQIEISA-N
XLogP2.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,2-dimethyl-1,3-dioxolan-4-yl)aniline
CID 117275390
4-(4-ethynylphenyl)-2,2-dimethyl-1,3-dioxolane
CID 151208021
2-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]acetic acid
CID 117344858
3-(2,2-dimethyl-1,3-dioxolan-4-yl)benzonitrile
CID 117291540
2-[3-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]propan-2-amine
CID 117343489
2-[2-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]-2-oxoacetic acid
CID 117378520
1-[3-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]ethanamine
CID 117316672
1-[[4-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]methyl]cyclopropan-1-amine
CID 117371295
1-[[3-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]methyl]cyclopropan-1-amine
CID 117371294
3-[3-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]piperidine
CID 117408145
2-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]-2-methoxyacetic acid
CID 151481552
4-[3-(isocyanatomethyl)phenyl]-2,2-dimethyl-1,3-dioxolane
CID 117338027

Frequently Asked Questions

What is the IUPAC name of (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane?
The IUPAC name of (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane (CID 11344328) is (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane.
What is the SMILES notation for (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane?
The canonical SMILES for (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane is CC1(C)OC[C@@H](c2ccccc2)O1.
What is the InChIKey of (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane?
The InChIKey is SFDXYHMRHIVYET-JTQLQIEISA-N. The full InChI is InChI=1S/C11H14O2/c1-11(2)12-8-10(13-11)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3/t10-/m0/s1.
What are the key properties of (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane?
(4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane has a molecular weight of 178.23 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2,2-dimethyl-4-phenyl-1,3-dioxolane is sourced from PubChem (CID 11344328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).