1,1,3,3-tetramethylcyclobutane

C8H16 — CID 3340552

IUPAC1,1,3,3-tetramethylcyclobutane
SMILESCC1(C)CC(C)(C)C1
InChIInChI=1S/C8H16/c1-7(2)5-8(3,4)6-7/h5-6H2,1-4H3
InChIKeyVIJZZJKGTNSBLL-UHFFFAOYSA-N
MW112.22 g/mol
LogP2.83
Rot. Bonds

About 1,1,3,3-tetramethylcyclobutane

1,1,3,3-tetramethylcyclobutane (PubChem CID 3340552) has the molecular formula C8H16 and a molecular weight of 112.22 g/mol. Its IUPAC name is 1,1,3,3-tetramethylcyclobutane.

Molecular Properties

Compound Name1,1,3,3-tetramethylcyclobutane
PubChem CID3340552
Molecular FormulaC8H16
Molecular Weight112.22 g/mol
Exact Mass112.13
IUPAC Name1,1,3,3-tetramethylcyclobutane
SMILESCC1(C)CC(C)(C)C1
InChIInChI=1S/C8H16/c1-7(2)5-8(3,4)6-7/h5-6H2,1-4H3
InChIKeyVIJZZJKGTNSBLL-UHFFFAOYSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.22
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetramethylcyclobutane?
The IUPAC name of 1,1,3,3-tetramethylcyclobutane (CID 3340552) is 1,1,3,3-tetramethylcyclobutane.
What is the SMILES notation for 1,1,3,3-tetramethylcyclobutane?
The canonical SMILES for 1,1,3,3-tetramethylcyclobutane is CC1(C)CC(C)(C)C1.
What is the InChIKey of 1,1,3,3-tetramethylcyclobutane?
The InChIKey is VIJZZJKGTNSBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16/c1-7(2)5-8(3,4)6-7/h5-6H2,1-4H3.
What are the key properties of 1,1,3,3-tetramethylcyclobutane?
1,1,3,3-tetramethylcyclobutane has a molecular weight of 112.22 g/mol, XLogP of 2.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetramethylcyclobutane is sourced from PubChem (CID 3340552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).