5,5,6,7-tetramethylspiro[2.4]hept-6-ene

C11H18 — CID 123406122

IUPAC5,5,6,7-tetramethylspiro[2.4]hept-6-ene
SMILESCC1=C(C)C2(CC2)CC1(C)C
InChIInChI=1S/C11H18/c1-8-9(2)11(5-6-11)7-10(8,3)4/h5-7H2,1-4H3
InChIKeyLOIGOBABCFVZLE-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.53
Rot. Bonds

About 5,5,6,7-tetramethylspiro[2.4]hept-6-ene

5,5,6,7-tetramethylspiro[2.4]hept-6-ene (PubChem CID 123406122) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 5,5,6,7-tetramethylspiro[2.4]hept-6-ene.

Molecular Properties

Compound Name5,5,6,7-tetramethylspiro[2.4]hept-6-ene
PubChem CID123406122
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name5,5,6,7-tetramethylspiro[2.4]hept-6-ene
SMILESCC1=C(C)C2(CC2)CC1(C)C
InChIInChI=1S/C11H18/c1-8-9(2)11(5-6-11)7-10(8,3)4/h5-7H2,1-4H3
InChIKeyLOIGOBABCFVZLE-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,2,4,4-Tetramethylcyclopentene
CID 144123
Cyclopentene, 1,2,3,3,4-pentamethyl-
CID 579269
1,2,3,3-Tetramethylcyclopentene
CID 14141137
1,2,5,5-Tetramethylcycloheptene
CID 14029511
4,5,6,7-Tetramethylspiro[2.4]hepta-4,6-diene
CID 11768723
Octamethylcyclopentene
CID 13293893
1,3,3-Trimethyl-2-(2-methyl-cyclopropyl)-cyclohexene
CID 595941
1,2-Di-tert-butyl-3,3-dimethylcyclopropene
CID 12418182
5-Fluoro-4-methylspiro[2.4]hept-4-ene
CID 21589413
8-Cyclopropylidenespiro[3.4]octane
CID 13662129
1,1-Dimethyl-2-(1-methylethylidene)-cyclopentane
CID 85980835
1,2-Di(t-butyl)cyclopent-1-ene
CID 10559298

Frequently Asked Questions

What is the IUPAC name of 5,5,6,7-tetramethylspiro[2.4]hept-6-ene?
The IUPAC name of 5,5,6,7-tetramethylspiro[2.4]hept-6-ene (CID 123406122) is 5,5,6,7-tetramethylspiro[2.4]hept-6-ene.
What is the SMILES notation for 5,5,6,7-tetramethylspiro[2.4]hept-6-ene?
The canonical SMILES for 5,5,6,7-tetramethylspiro[2.4]hept-6-ene is CC1=C(C)C2(CC2)CC1(C)C.
What is the InChIKey of 5,5,6,7-tetramethylspiro[2.4]hept-6-ene?
The InChIKey is LOIGOBABCFVZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-8-9(2)11(5-6-11)7-10(8,3)4/h5-7H2,1-4H3.
What are the key properties of 5,5,6,7-tetramethylspiro[2.4]hept-6-ene?
5,5,6,7-tetramethylspiro[2.4]hept-6-ene has a molecular weight of 150.26 g/mol, XLogP of 3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,6,7-tetramethylspiro[2.4]hept-6-ene is sourced from PubChem (CID 123406122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).