6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene

C15H22 — CID 23270637

IUPAC6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene
SMILESCC1(C)Cc2ccccc2CC(C)(C)C1
InChIInChI=1S/C15H22/c1-14(2)9-12-7-5-6-8-13(12)10-15(3,4)11-14/h5-8H,9-11H2,1-4H3
InChIKeyNHUNFQUMJAISHX-UHFFFAOYSA-N
MW202.34 g/mol
LogP4.23
Rot. Bonds

About 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene

6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene (PubChem CID 23270637) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene.

Molecular Properties

Compound Name6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene
PubChem CID23270637
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene
SMILESCC1(C)Cc2ccccc2CC(C)(C)C1
InChIInChI=1S/C15H22/c1-14(2)9-12-7-5-6-8-13(12)10-15(3,4)11-14/h5-8H,9-11H2,1-4H3
InChIKeyNHUNFQUMJAISHX-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 ≤ 500202.34
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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(2S)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene?
The IUPAC name of 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene (CID 23270637) is 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene.
What is the SMILES notation for 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene?
The canonical SMILES for 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene is CC1(C)Cc2ccccc2CC(C)(C)C1.
What is the InChIKey of 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene?
The InChIKey is NHUNFQUMJAISHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22/c1-14(2)9-12-7-5-6-8-13(12)10-15(3,4)11-14/h5-8H,9-11H2,1-4H3.
What are the key properties of 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene?
6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene has a molecular weight of 202.34 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 6,6,8,8-tetramethyl-7,9-dihydro-5H-benzo[7]annulene is sourced from PubChem (CID 23270637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).