2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene

C18H16F4O2 — CID 22140456

IUPAC2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene
SMILESCOCC1(C(C)OC)c2cc(F)c(F)cc2-c2cc(F)c(F)cc21
InChIInChI=1S/C18H16F4O2/c1-9(24-3)18(8-23-2)12-6-16(21)14(19)4-10(12)11-5-15(20)17(22)7-13(11)18/h4-7,9H,8H2,1-3H3
InChIKeyCQNWWQKMMODDOL-UHFFFAOYSA-N
MW340.32 g/mol
LogP4.19
Rot. Bonds4

About 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene

2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene (PubChem CID 22140456) has the molecular formula C18H16F4O2 and a molecular weight of 340.32 g/mol. Its IUPAC name is 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene.

Molecular Properties

Compound Name2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene
PubChem CID22140456
Molecular FormulaC18H16F4O2
Molecular Weight340.32 g/mol
Exact Mass340.11
IUPAC Name2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene
SMILESCOCC1(C(C)OC)c2cc(F)c(F)cc2-c2cc(F)c(F)cc21
InChIInChI=1S/C18H16F4O2/c1-9(24-3)18(8-23-2)12-6-16(21)14(19)4-10(12)11-5-15(20)17(22)7-13(11)18/h4-7,9H,8H2,1-3H3
InChIKeyCQNWWQKMMODDOL-UHFFFAOYSA-N
XLogP4.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.32
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9,9-Bis(methoxymethyl)-9H-fluorene
CID 11054211
[2-Fluoro-9-(hydroxymethyl)fluoren-9-yl]methanol
CID 12885932
1,8-Difluoro-9,9-bis(methoxymethyl)fluorene
CID 21972408
2,3,4,5,6,7-Hexafluoro-9,9-bis(methoxymethyl)fluorene
CID 21972415
2,3,6,7-Tetrafluoro-1,1-bis(methoxymethyl)indene
CID 22140493
[2-Fluoro-9-(trimethylsilyloxymethyl)fluoren-9-yl]methoxy-trimethylsilane
CID 22639102
Triethyl-[[2-fluoro-9-(triethylsilyloxymethyl)fluoren-9-yl]methoxy]silane
CID 22639117
[9-[[Dimethyl(propyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-propylsilane
CID 22639120
Ethyl-[[9-[[ethyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
CID 22639121
Tert-butyl-[[9-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
CID 22639132
1,8-difluoro-9-(methoxymethyl)-9H-fluorene
CID 68801100
Butyl-[[9-[[butyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
CID 69305459

Frequently Asked Questions

What is the IUPAC name of 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene?
The IUPAC name of 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene (CID 22140456) is 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene.
What is the SMILES notation for 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene?
The canonical SMILES for 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene is COCC1(C(C)OC)c2cc(F)c(F)cc2-c2cc(F)c(F)cc21.
What is the InChIKey of 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene?
The InChIKey is CQNWWQKMMODDOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F4O2/c1-9(24-3)18(8-23-2)12-6-16(21)14(19)4-10(12)11-5-15(20)17(22)7-13(11)18/h4-7,9H,8H2,1-3H3.
What are the key properties of 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene?
2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene has a molecular weight of 340.32 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,6,7-tetrafluoro-9-(1-methoxyethyl)-9-(methoxymethyl)fluorene is sourced from PubChem (CID 22140456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).