1-methyl-9H-fluorene

C14H12 — CID 15604

IUPAC1-methyl-9H-fluorene
SMILESCc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C14H12/c1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13/h2-8H,9H2,1H3
InChIKeyGKEUODMJRFDLJY-UHFFFAOYSA-N
MW180.25 g/mol
LogP3.57
Rot. Bonds

About 1-methyl-9H-fluorene

1-methyl-9H-fluorene (PubChem CID 15604) has the molecular formula C14H12 and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-methyl-9H-fluorene.

Molecular Properties

Compound Name1-methyl-9H-fluorene
PubChem CID15604
Molecular FormulaC14H12
Molecular Weight180.25 g/mol
Exact Mass180.09
IUPAC Name1-methyl-9H-fluorene
SMILESCc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C14H12/c1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13/h2-8H,9H2,1H3
InChIKeyGKEUODMJRFDLJY-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-9H-fluorene?
The IUPAC name of 1-methyl-9H-fluorene (CID 15604) is 1-methyl-9H-fluorene.
What is the SMILES notation for 1-methyl-9H-fluorene?
The canonical SMILES for 1-methyl-9H-fluorene is Cc1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-methyl-9H-fluorene?
The InChIKey is GKEUODMJRFDLJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12/c1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13/h2-8H,9H2,1H3.
What are the key properties of 1-methyl-9H-fluorene?
1-methyl-9H-fluorene has a molecular weight of 180.25 g/mol, XLogP of 3.57, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-9H-fluorene is sourced from PubChem (CID 15604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).