1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane

C83H182O6 — CID 158171826

IUPAC1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane
SMILESC.CC.CC.CC.CC.CC.CC.CC.CC(C)C1(C(C)C)CCC1.CC(C)C1(C(C)C)CCCC1.CC(C)C1(C(C)C)CCCO1.CC(C)C1(C(C)C)CCO1.CC(C)C1(C(C)C)CCOC1.CC(C)C1(C(C)C)COC1.CC(C)C1(C(C)C)OCCO1
InChIInChI=1S/C11H22.2C10H20O.C10H20.C9H18O2.2C9H18O.7C2H6.CH4/c1-9(2)11(10(3)4)7-5-6-8-11;1-8(2)10(9(3)4)5-6-11-7-10;1-8(2)10(9(3)4)6-5-7-11-10;1-8(2)10(9(3)4)6-5-7-10;1-7(2)9(8(3)4)10-5-6-11-9;1-7(2)9(8(3)4)5-10-6-9;1-7(2)9(8(3)4)5-6-10-9;7*1-2;/h9-10H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3;2*7-8H,5-6H2,1-4H3;7*1-2H3;1H4
InChIKeyFXNUIJHXAMFHKZ-UHFFFAOYSA-N
MW1276.36 g/mol
LogP27.51
Rot. Bonds14

About 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane

1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane (PubChem CID 158171826) has the molecular formula C83H182O6 and a molecular weight of 1276.36 g/mol. Its IUPAC name is 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane.

Molecular Properties

Compound Name1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane
PubChem CID158171826
Molecular FormulaC83H182O6
Molecular Weight1276.36 g/mol
Exact Mass1275.39
IUPAC Name1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane
SMILESC.CC.CC.CC.CC.CC.CC.CC.CC(C)C1(C(C)C)CCC1.CC(C)C1(C(C)C)CCCC1.CC(C)C1(C(C)C)CCCO1.CC(C)C1(C(C)C)CCO1.CC(C)C1(C(C)C)CCOC1.CC(C)C1(C(C)C)COC1.CC(C)C1(C(C)C)OCCO1
InChIInChI=1S/C11H22.2C10H20O.C10H20.C9H18O2.2C9H18O.7C2H6.CH4/c1-9(2)11(10(3)4)7-5-6-8-11;1-8(2)10(9(3)4)5-6-11-7-10;1-8(2)10(9(3)4)6-5-7-11-10;1-8(2)10(9(3)4)6-5-7-10;1-7(2)9(8(3)4)10-5-6-11-9;1-7(2)9(8(3)4)5-10-6-9;1-7(2)9(8(3)4)5-6-10-9;7*1-2;/h9-10H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3;2*7-8H,5-6H2,1-4H3;7*1-2H3;1H4
InChIKeyFXNUIJHXAMFHKZ-UHFFFAOYSA-N
XLogP27.51
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms89
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001276.36
LogP ≤ 527.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane with MolForge

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Related Compounds

bis(1,1-di(propan-2-yl)cyclobutane);bis(1,1-di(propan-2-yl)cyclohexane);1,1-di(propan-2-yl)cyclopropane;4,4-di(propan-2-yl)oxane;3,3-di(propan-2-yl)oxetane
CID 157257202
1,1-di(propan-2-yl)cyclohexane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-3H-furan;2,2-di(propan-2-yl)oxane;2,2-di(propan-2-yl)oxolane;methane
CID 160897967
2,2-di(propan-2-yl)-1,3-dioxane;2,2-di(propan-2-yl)-1,3-dioxolane;methane
CID 158994829
1,1-di(propan-2-yl)cycloheptane
CID 23589303
4,4-di(propan-2-yl)azepane;2,2-di(propan-2-yl)oxane;3,3-di(propan-2-yl)oxane;4,4-di(propan-2-yl)oxane;2,2-di(propan-2-yl)piperidine;3,3-di(propan-2-yl)piperidine;2,2-di(propan-2-yl)thiane;3,3-di(propan-2-yl)thiane;4,4-di(propan-2-yl)thiane;ethane
CID 159996295
1,4-dioxane;2,2-di(propan-2-yl)-1,4-dioxane
CID 158582270
1,1-difluoro-3,3-di(propan-2-yl)cyclobutane;1,1-difluoro-4,4-di(propan-2-yl)cyclohexane;4-(difluoromethylidene)-1,1-di(propan-2-yl)cyclohexane;1,1-di(propan-2-yl)-4,4-bis(trifluoromethyl)cyclohexane;1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclohexane;4,4-di(propan-2-yl)cyclohexene;1,1-di(propan-2-yl)cyclopentane;4,4-di(propan-2-yl)cyclopentene;4,4-di(propan-2-yl)oxane;7,7-di(propan-2-yl)-2-oxaspiro[3.5]nonane;3,3-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxolane;1,1-di(propan-2-yl)-4-propan-2-ylidenecyclohexane;7,7-di(propan-2-yl)spiro[3.5]nonane;6,6-di(propan-2-yl)spiro[2.5]octane;4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,1-di(propan-2-yl)cyclohexane;4-methylidene-1,1-di(propan-2-yl)cyclohexane
CID 157239748
(2R)-2-methyl-2-propan-2-yloxolane
CID 59911363
1-(1-propan-2-ylcyclohexyl)ethanol
CID 69271038
(2-propan-2-yloxan-2-yl)silane
CID 123630971
1,1-di(propan-2-yl)cyclobutane;propan-2-ylcyclobutane;3-propan-2-yloxolane
CID 163492322
1,4-dioxaspiro[4.5]decane;ethane
CID 143191896

Frequently Asked Questions

What is the IUPAC name of 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane?
The IUPAC name of 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane (CID 158171826) is 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane.
What is the SMILES notation for 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane?
The canonical SMILES for 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane is C.CC.CC.CC.CC.CC.CC.CC.CC(C)C1(C(C)C)CCC1.CC(C)C1(C(C)C)CCCC1.CC(C)C1(C(C)C)CCCO1.CC(C)C1(C(C)C)CCO1.CC(C)C1(C(C)C)CCOC1.CC(C)C1(C(C)C)COC1.CC(C)C1(C(C)C)OCCO1.
What is the InChIKey of 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane?
The InChIKey is FXNUIJHXAMFHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22.2C10H20O.C10H20.C9H18O2.2C9H18O.7C2H6.CH4/c1-9(2)11(10(3)4)7-5-6-8-11;1-8(2)10(9(3)4)5-6-11-7-10;1-8(2)10(9(3)4)6-5-7-11-10;1-8(2)10(9(3)4)6-5-7-10;1-7(2)9(8(3)4)10-5-6-11-9;1-7(2)9(8(3)4)5-10-6-9;1-7(2)9(8(3)4)5-6-10-9;7*1-2;/h9-10H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3;2*7-8H,5-6H2,1-4H3;7*1-2H3;1H4.
What are the key properties of 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane?
1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane has a molecular weight of 1276.36 g/mol, XLogP of 27.51, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-di(propan-2-yl)cyclobutane;1,1-di(propan-2-yl)cyclopentane;2,2-di(propan-2-yl)-1,3-dioxolane;2,2-di(propan-2-yl)oxetane;3,3-di(propan-2-yl)oxetane;2,2-di(propan-2-yl)oxolane;3,3-di(propan-2-yl)oxolane;ethane;methane is sourced from PubChem (CID 158171826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).