(2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane

C8H16O2 — CID 155082762

IUPAC(2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane
SMILESCC1CO[C@](C)(C(C)C)O1
InChIInChI=1S/C8H16O2/c1-6(2)8(4)9-5-7(3)10-8/h6-7H,5H2,1-4H3/t7?,8-/m0/s1
InChIKeyKYASJMMKTOPSEK-MQWKRIRWSA-N
MW144.21 g/mol
LogP1.79
Rot. Bonds1

About (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane

(2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane (PubChem CID 155082762) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane.

Molecular Properties

Compound Name(2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane
PubChem CID155082762
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane
SMILESCC1CO[C@](C)(C(C)C)O1
InChIInChI=1S/C8H16O2/c1-6(2)8(4)9-5-7(3)10-8/h6-7H,5H2,1-4H3/t7?,8-/m0/s1
InChIKeyKYASJMMKTOPSEK-MQWKRIRWSA-N
XLogP1.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-dimethyl-1,3-dioxolan-2-yl)propane-1-thiol
CID 147288645
1-(2,4-dimethyl-1,3-dioxolan-2-yl)ethoxy-diethoxy-ethylsilane
CID 141063946
2-but-2-en-2-yl-2,4-dimethyl-1,3-dioxolane
CID 69112241
2,4-dimethyl-1,3-dioxolane-2-carboxylic acid;hydrofluoride
CID 146547924
4,6-dimethyl-2,2-di(propan-2-yl)-1,3-dioxane
CID 70641039
3-methyl-1,4,6,10-tetraoxaspiro[4.5]decane
CID 15588101
sulfamoyl chloride;2,2,4-trimethyl-1,3-dioxolane
CID 87571306
8-butan-2-yl-3-methyl-1,4-dioxaspiro[4.5]decane
CID 163456657
(2R,4S)-2,4-dimethyl-2-propan-2-yl-1,3-oxathiolane
CID 131854769
1-(2,4-dimethyl-1,3-dioxolan-2-yl)propan-1-one
CID 175532850
2,4-dimethyl-2-(2-methylpropyl)-1,3-dioxane
CID 69265472
2,4-dimethyl-2-propan-2-yl-1,3-oxazolidine;hydrochloride
CID 117228417

Frequently Asked Questions

What is the IUPAC name of (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane?
The IUPAC name of (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane (CID 155082762) is (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane.
What is the SMILES notation for (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane?
The canonical SMILES for (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane is CC1CO[C@](C)(C(C)C)O1.
What is the InChIKey of (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane?
The InChIKey is KYASJMMKTOPSEK-MQWKRIRWSA-N. The full InChI is InChI=1S/C8H16O2/c1-6(2)8(4)9-5-7(3)10-8/h6-7H,5H2,1-4H3/t7?,8-/m0/s1.
What are the key properties of (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane?
(2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane has a molecular weight of 144.21 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,4-dimethyl-2-propan-2-yl-1,3-dioxolane is sourced from PubChem (CID 155082762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).