1,3,6,7-tetramethyl-9H-fluorene

C17H18 — CID 59561051

IUPAC1,3,6,7-tetramethyl-9H-fluorene
SMILESCc1cc(C)c2c(c1)-c1cc(C)c(C)cc1C2
InChIInChI=1S/C17H18/c1-10-5-13(4)15-9-14-7-11(2)12(3)8-16(14)17(15)6-10/h5-8H,9H2,1-4H3
InChIKeyCQAUNCLTCWDSCJ-UHFFFAOYSA-N
MW222.33 g/mol
LogP4.49
Rot. Bonds

About 1,3,6,7-tetramethyl-9H-fluorene

1,3,6,7-tetramethyl-9H-fluorene (PubChem CID 59561051) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is 1,3,6,7-tetramethyl-9H-fluorene.

Molecular Properties

Compound Name1,3,6,7-tetramethyl-9H-fluorene
PubChem CID59561051
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name1,3,6,7-tetramethyl-9H-fluorene
SMILESCc1cc(C)c2c(c1)-c1cc(C)c(C)cc1C2
InChIInChI=1S/C17H18/c1-10-5-13(4)15-9-14-7-11(2)12(3)8-16(14)17(15)6-10/h5-8H,9H2,1-4H3
InChIKeyCQAUNCLTCWDSCJ-UHFFFAOYSA-N
XLogP4.49
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 ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,3,6,7-tetramethyl-9H-fluorene?
The IUPAC name of 1,3,6,7-tetramethyl-9H-fluorene (CID 59561051) is 1,3,6,7-tetramethyl-9H-fluorene.
What is the SMILES notation for 1,3,6,7-tetramethyl-9H-fluorene?
The canonical SMILES for 1,3,6,7-tetramethyl-9H-fluorene is Cc1cc(C)c2c(c1)-c1cc(C)c(C)cc1C2.
What is the InChIKey of 1,3,6,7-tetramethyl-9H-fluorene?
The InChIKey is CQAUNCLTCWDSCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18/c1-10-5-13(4)15-9-14-7-11(2)12(3)8-16(14)17(15)6-10/h5-8H,9H2,1-4H3.
What are the key properties of 1,3,6,7-tetramethyl-9H-fluorene?
1,3,6,7-tetramethyl-9H-fluorene has a molecular weight of 222.33 g/mol, XLogP of 4.49, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,6,7-tetramethyl-9H-fluorene is sourced from PubChem (CID 59561051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).