7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane

C14H16 — CID 11217645

IUPAC7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane
SMILESC1CC12C(=C1C3(CC3)C13CC3)C21CC1
InChIInChI=1S/C14H16/c1-2-11(1)9(12(11)3-4-12)10-13(5-6-13)14(10)7-8-14/h1-8H2
InChIKeyLJWIIKNUHZTHDT-UHFFFAOYSA-N
MW184.28 g/mol
LogP3.43
Rot. Bonds

About 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane

7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane (PubChem CID 11217645) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane.

Molecular Properties

Compound Name7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane
PubChem CID11217645
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane
SMILESC1CC12C(=C1C3(CC3)C13CC3)C21CC1
InChIInChI=1S/C14H16/c1-2-11(1)9(12(11)3-4-12)10-13(5-6-13)14(10)7-8-14/h1-8H2
InChIKeyLJWIIKNUHZTHDT-UHFFFAOYSA-N
XLogP3.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 53.43
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 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane?
The IUPAC name of 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane (CID 11217645) is 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane.
What is the SMILES notation for 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane?
The canonical SMILES for 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane is C1CC12C(=C1C3(CC3)C13CC3)C21CC1.
What is the InChIKey of 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane?
The InChIKey is LJWIIKNUHZTHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16/c1-2-11(1)9(12(11)3-4-12)10-13(5-6-13)14(10)7-8-14/h1-8H2.
What are the key properties of 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane?
7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane has a molecular weight of 184.28 g/mol, XLogP of 3.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-dispiro[2.0.24.13]heptan-7-ylidenedispiro[2.0.24.13]heptane is sourced from PubChem (CID 11217645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).