4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene

C11H16 — CID 11768723

IUPAC4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene
SMILESCC1=C(C)C2(CC2)C(C)=C1C
InChIInChI=1S/C11H16/c1-7-8(2)10(4)11(5-6-11)9(7)3/h5-6H2,1-4H3
InChIKeySFDCZPLGNBKVCY-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.45
Rot. Bonds

About 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene

4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene (PubChem CID 11768723) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene.

Molecular Properties

Compound Name4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene
PubChem CID11768723
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene
SMILESCC1=C(C)C2(CC2)C(C)=C1C
InChIInChI=1S/C11H16/c1-7-8(2)10(4)11(5-6-11)9(7)3/h5-6H2,1-4H3
InChIKeySFDCZPLGNBKVCY-UHFFFAOYSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-Cyclopentadiene, 1,2,3,4,5,5-hexamethyl-
CID 138108
5-Ethenyl-1,2,3,4,5-pentamethylcyclopenta-1,3-diene
CID 291896
5-Ethyl-1,2,3,5-tetramethylcyclopenta-1,3-diene
CID 18428884
1,2,4,5,5-Pentamethylcyclopentadiene
CID 19958028
Pentamethyl(vinyl)cyclopentadiene
CID 129813296
5-Tert-butyl-1,2,3,4-tetramethylcyclopenta-1,3-diene
CID 11986068
5-Tri-deuteromethyl-1,2,3,4,5-pentamethyl-1,3-cyclopenta-diene
CID 23266468
4-Methylspiro(2.4)hepta-4,6-diene
CID 144247
1,1-Dimethyl-2,3-di(propan-2-ylidene)cyclopropane
CID 584335
5-Ethyl-1,2,3,4,5-pentamethylcyclopenta-1,3-diene
CID 15274402
1-Tert-butyl-2,3,4,5-tetramethylcyclopenta-1,3-diene
CID 15798419
1,2,3,3-Tetramethyl-5-propan-2-ylidenecyclopentene
CID 21018111

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene?
The IUPAC name of 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene (CID 11768723) is 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene.
What is the SMILES notation for 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene?
The canonical SMILES for 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene is CC1=C(C)C2(CC2)C(C)=C1C.
What is the InChIKey of 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene?
The InChIKey is SFDCZPLGNBKVCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-7-8(2)10(4)11(5-6-11)9(7)3/h5-6H2,1-4H3.
What are the key properties of 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene?
4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene has a molecular weight of 148.25 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetramethylspiro[2.4]hepta-4,6-diene is sourced from PubChem (CID 11768723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).