1,8-dimethyl-9H-fluorene

C15H14 — CID 4124506

IUPAC1,8-dimethyl-9H-fluorene
SMILESCc1cccc2c1Cc1c(C)cccc1-2
InChIInChI=1S/C15H14/c1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-14(10)12/h3-8H,9H2,1-2H3
InChIKeyIJGGQBIUSGOOCA-UHFFFAOYSA-N
MW194.28 g/mol
LogP3.87
Rot. Bonds

About 1,8-dimethyl-9H-fluorene

1,8-dimethyl-9H-fluorene (PubChem CID 4124506) has the molecular formula C15H14 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1,8-dimethyl-9H-fluorene.

Molecular Properties

Compound Name1,8-dimethyl-9H-fluorene
PubChem CID4124506
Molecular FormulaC15H14
Molecular Weight194.28 g/mol
Exact Mass194.11
IUPAC Name1,8-dimethyl-9H-fluorene
SMILESCc1cccc2c1Cc1c(C)cccc1-2
InChIInChI=1S/C15H14/c1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-14(10)12/h3-8H,9H2,1-2H3
InChIKeyIJGGQBIUSGOOCA-UHFFFAOYSA-N
XLogP3.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,8-dimethyl-9H-fluorene?
The IUPAC name of 1,8-dimethyl-9H-fluorene (CID 4124506) is 1,8-dimethyl-9H-fluorene.
What is the SMILES notation for 1,8-dimethyl-9H-fluorene?
The canonical SMILES for 1,8-dimethyl-9H-fluorene is Cc1cccc2c1Cc1c(C)cccc1-2.
What is the InChIKey of 1,8-dimethyl-9H-fluorene?
The InChIKey is IJGGQBIUSGOOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14/c1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-14(10)12/h3-8H,9H2,1-2H3.
What are the key properties of 1,8-dimethyl-9H-fluorene?
1,8-dimethyl-9H-fluorene has a molecular weight of 194.28 g/mol, XLogP of 3.87, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dimethyl-9H-fluorene is sourced from PubChem (CID 4124506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).