7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene

C10H16O2 — CID 170927555

IUPAC7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene
SMILESCC1(C)C2=C(OCCO2)C1(C)C
InChIInChI=1S/C10H16O2/c1-9(2)7-8(10(9,3)4)12-6-5-11-7/h5-6H2,1-4H3
InChIKeyUIJYKMJHAWYKEJ-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.31
Rot. Bonds

About 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene

7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene (PubChem CID 170927555) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene.

Molecular Properties

Compound Name7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene
PubChem CID170927555
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene
SMILESCC1(C)C2=C(OCCO2)C1(C)C
InChIInChI=1S/C10H16O2/c1-9(2)7-8(10(9,3)4)12-6-5-11-7/h5-6H2,1-4H3
InChIKeyUIJYKMJHAWYKEJ-UHFFFAOYSA-N
XLogP2.31
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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(3S)-3-bromo-3-methyloxolan-2-one
CID 15939456
5,5,11,11-tetramethyl-1,3,7,9-tetraoxacyclododecane-4,6,10,12-tetrone
CID 175887369
3,3-dimethyl-oxacyclopentadecan-2-one
CID 71147227
2,2-dimethyl-7,8,11-trioxatricyclo[10.2.2.23,6]octadeca-1(14),3(18),4,6(17),12,15-hexaene
CID 87852503
(1S,5R)-7,7-dimethyl-2-oxabicyclo[3.1.1]heptan-6-one
CID 130832297
3,3,4,4-tetramethyl-oxacyclopentadecan-2-one
CID 150459671
4,5,6-trimethyl-4-(trifluoromethyl)-2,3-dihydropyran
CID 67968794
1,15,18,32-tetramethyl-5,8,11,22,25,28,36,39,42,49,52,55-dodecaoxaundecacyclo[30.26.2.02,31.04,29.012,21.014,19.015,46.018,45.033,58.035,56.043,48]hexaconta-2,4(29),12(21),13,19,30,33,35(56),43(48),44,46,57-dodecaene
CID 101440695
1,3-dioxolan-2-one
CID 7303
4,5-dimethyl-1,3-dioxole
CID 13058524

Frequently Asked Questions

What is the IUPAC name of 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene?
The IUPAC name of 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene (CID 170927555) is 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene.
What is the SMILES notation for 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene?
The canonical SMILES for 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene is CC1(C)C2=C(OCCO2)C1(C)C.
What is the InChIKey of 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene?
The InChIKey is UIJYKMJHAWYKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-9(2)7-8(10(9,3)4)12-6-5-11-7/h5-6H2,1-4H3.
What are the key properties of 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene?
7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene has a molecular weight of 168.24 g/mol, XLogP of 2.31, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene is sourced from PubChem (CID 170927555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).