2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran

C14H26O — CID 59908870

IUPAC2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran
SMILESCC1=C(C)C(C(C)(C)C)C(C(C)(C)C)O1
InChIInChI=1S/C14H26O/c1-9-10(2)15-12(14(6,7)8)11(9)13(3,4)5/h11-12H,1-8H3
InChIKeyROZSJQOWSSJNIK-UHFFFAOYSA-N
MW210.36 g/mol
LogP4.39
Rot. Bonds

About 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran

2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran (PubChem CID 59908870) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran.

Molecular Properties

Compound Name2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran
PubChem CID59908870
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran
SMILESCC1=C(C)C(C(C)(C)C)C(C(C)(C)C)O1
InChIInChI=1S/C14H26O/c1-9-10(2)15-12(14(6,7)8)11(9)13(3,4)5/h11-12H,1-8H3
InChIKeyROZSJQOWSSJNIK-UHFFFAOYSA-N
XLogP4.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 58446547
2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrothiophene 1-oxide
CID 59908911
4-tert-butyl-3-methyloxetan-2-one
CID 13024580
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CID 118642850
2,3-ditert-butyloxan-4-one
CID 164734446
7,8-ditert-butylbicyclo[2.2.2]octa-1,3,5-triene
CID 148801538
4,5-ditert-butyl-1,3-oxathiolan-2-one
CID 20744982
2-tert-butyl-4-methyl-1,3-oxathiol-5-ol
CID 86036382
2,3-ditert-butyl-5-chloro-2,3-dihydrofuran
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4-tert-butyl-5-(2-methylbutan-2-yl)-1,3-dioxolan-2-one
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Frequently Asked Questions

What is the IUPAC name of 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran?
The IUPAC name of 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran (CID 59908870) is 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran.
What is the SMILES notation for 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran?
The canonical SMILES for 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran is CC1=C(C)C(C(C)(C)C)C(C(C)(C)C)O1.
What is the InChIKey of 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran?
The InChIKey is ROZSJQOWSSJNIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-9-10(2)15-12(14(6,7)8)11(9)13(3,4)5/h11-12H,1-8H3.
What are the key properties of 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran?
2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran has a molecular weight of 210.36 g/mol, XLogP of 4.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-ditert-butyl-4,5-dimethyl-2,3-dihydrofuran is sourced from PubChem (CID 59908870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).