3,3,4,4-tetramethyl-1-propylcyclobutene

C11H20 — CID 134993494

IUPAC3,3,4,4-tetramethyl-1-propylcyclobutene
SMILESCCCC1=CC(C)(C)C1(C)C
InChIInChI=1S/C11H20/c1-6-7-9-8-10(2,3)11(9,4)5/h8H,6-7H2,1-5H3
InChIKeyXMFIGKMRZHHWFH-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.78
Rot. Bonds2

About 3,3,4,4-tetramethyl-1-propylcyclobutene

3,3,4,4-tetramethyl-1-propylcyclobutene (PubChem CID 134993494) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 3,3,4,4-tetramethyl-1-propylcyclobutene.

Molecular Properties

Compound Name3,3,4,4-tetramethyl-1-propylcyclobutene
PubChem CID134993494
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name3,3,4,4-tetramethyl-1-propylcyclobutene
SMILESCCCC1=CC(C)(C)C1(C)C
InChIInChI=1S/C11H20/c1-6-7-9-8-10(2,3)11(9,4)5/h8H,6-7H2,1-5H3
InChIKeyXMFIGKMRZHHWFH-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3,4,4-tetramethyl-1-propylcyclobutene?
The IUPAC name of 3,3,4,4-tetramethyl-1-propylcyclobutene (CID 134993494) is 3,3,4,4-tetramethyl-1-propylcyclobutene.
What is the SMILES notation for 3,3,4,4-tetramethyl-1-propylcyclobutene?
The canonical SMILES for 3,3,4,4-tetramethyl-1-propylcyclobutene is CCCC1=CC(C)(C)C1(C)C.
What is the InChIKey of 3,3,4,4-tetramethyl-1-propylcyclobutene?
The InChIKey is XMFIGKMRZHHWFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-6-7-9-8-10(2,3)11(9,4)5/h8H,6-7H2,1-5H3.
What are the key properties of 3,3,4,4-tetramethyl-1-propylcyclobutene?
3,3,4,4-tetramethyl-1-propylcyclobutene has a molecular weight of 152.28 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4-tetramethyl-1-propylcyclobutene is sourced from PubChem (CID 134993494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).