8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene

C15H18 — CID 91346586

IUPAC8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene
SMILESC=C1CC(C)C(=C)CCc2ccccc21
InChIInChI=1S/C15H18/c1-11-8-9-14-6-4-5-7-15(14)13(3)10-12(11)2/h4-7,12H,1,3,8-10H2,2H3
InChIKeyUVYOHYRGMJMHBI-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.23
Rot. Bonds

About 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene

8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene (PubChem CID 91346586) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene.

Molecular Properties

Compound Name8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene
PubChem CID91346586
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene
SMILESC=C1CC(C)C(=C)CCc2ccccc21
InChIInChI=1S/C15H18/c1-11-8-9-14-6-4-5-7-15(14)13(3)10-12(11)2/h4-7,12H,1,3,8-10H2,2H3
InChIKeyUVYOHYRGMJMHBI-UHFFFAOYSA-N
XLogP4.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.23
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 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene?
The IUPAC name of 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene (CID 91346586) is 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene.
What is the SMILES notation for 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene?
The canonical SMILES for 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene is C=C1CC(C)C(=C)CCc2ccccc21.
What is the InChIKey of 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene?
The InChIKey is UVYOHYRGMJMHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-11-8-9-14-6-4-5-7-15(14)13(3)10-12(11)2/h4-7,12H,1,3,8-10H2,2H3.
What are the key properties of 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene?
8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene has a molecular weight of 198.31 g/mol, XLogP of 4.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-7,10-dimethylidene-5,6,8,9-tetrahydrobenzo[8]annulene is sourced from PubChem (CID 91346586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).