2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane

C17H18 — CID 134900802

IUPAC2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane
SMILESC=C1CC12CC21CC12CC21CC12CC21CC1=C
InChIInChI=1S/C17H18/c1-10-3-12(10)5-14(12)7-16(14)9-17(16)8-15(17)6-13(15)4-11(13)2/h1-9H2
InChIKeyIJMPORIDTROYIG-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.84
Rot. Bonds

About 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane

2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane (PubChem CID 134900802) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane.

Molecular Properties

Compound Name2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane
PubChem CID134900802
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane
SMILESC=C1CC12CC21CC12CC21CC12CC21CC1=C
InChIInChI=1S/C17H18/c1-10-3-12(10)5-14(12)7-16(14)9-17(16)8-15(17)6-13(15)4-11(13)2/h1-9H2
InChIKeyIJMPORIDTROYIG-UHFFFAOYSA-N
XLogP3.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.84
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 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane?
The IUPAC name of 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane (CID 134900802) is 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane.
What is the SMILES notation for 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane?
The canonical SMILES for 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane is C=C1CC12CC21CC12CC21CC12CC21CC1=C.
What is the InChIKey of 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane?
The InChIKey is IJMPORIDTROYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18/c1-10-3-12(10)5-14(12)7-16(14)9-17(16)8-15(17)6-13(15)4-11(13)2/h1-9H2.
What are the key properties of 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane?
2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane has a molecular weight of 222.33 g/mol, XLogP of 3.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-dimethylidenehexaspiro[2.0.0.0.0.0.28.17.16.15.14.13]pentadecane is sourced from PubChem (CID 134900802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).