7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene

C17H17FO2 — CID 147991606

IUPAC7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene
SMILESCOc1cc(OC)c2c(c1)C(C)(C)c1cc(F)ccc1-2
InChIInChI=1S/C17H17FO2/c1-17(2)13-7-10(18)5-6-12(13)16-14(17)8-11(19-3)9-15(16)20-4/h5-9H,1-4H3
InChIKeyIVEHGMLXEVTQSK-UHFFFAOYSA-N
MW272.32 g/mol
LogP4.15
Rot. Bonds2

About 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene

7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene (PubChem CID 147991606) has the molecular formula C17H17FO2 and a molecular weight of 272.32 g/mol. Its IUPAC name is 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene.

Molecular Properties

Compound Name7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene
PubChem CID147991606
Molecular FormulaC17H17FO2
Molecular Weight272.32 g/mol
Exact Mass272.12
IUPAC Name7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene
SMILESCOc1cc(OC)c2c(c1)C(C)(C)c1cc(F)ccc1-2
InChIInChI=1S/C17H17FO2/c1-17(2)13-7-10(18)5-6-12(13)16-14(17)8-11(19-3)9-15(16)20-4/h5-9H,1-4H3
InChIKeyIVEHGMLXEVTQSK-UHFFFAOYSA-N
XLogP4.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-5,9,9-trimethylfluorene
CID 126538436
2-fluoro-6,6,12,12-tetramethylindeno[1,2-b]fluoren-8-amine
CID 59742364
7-fluoro-2-methoxy-10,10-dimethyl-9H-phenanthrene
CID 175802586
3-fluoro-8-methoxy-6,6-dimethyl-5H-benzo[b]carbazol-11-one
CID 66834694
7-chloro-2,4-difluoro-9,9-dimethylfluorene
CID 156704590
9-fluoro-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one
CID 18380002
1,2,3,4,5-pentafluoro-6-(2,4,6-trimethoxyphenyl)benzene
CID 102431568
2-(2,6-difluorophenyl)-1,3,5-trimethoxybenzene
CID 175990083
2-fluoro-6-(2,4,6-trimethoxyphenyl)aniline
CID 107602929
2-[3-[3,5-bis(7-methoxy-9,9-dimethylfluoren-2-yl)phenyl]-5-(7-methoxy-9,9-dimethylfluoren-2-yl)phenyl]-7-methoxy-9,9-dimethylfluorene
CID 59858743
9-(7-methoxy-9,9-dimethylfluoren-2-yl)-10-[7-[10-(7-methoxy-9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9,9-dimethylfluoren-2-yl]anthracene
CID 20822065
3-(3,4-dimethoxyphenyl)-2-hydroxy-6,8-dimethoxy-4,4-dimethylnaphthalen-1-one
CID 14484539

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene?
The IUPAC name of 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene (CID 147991606) is 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene.
What is the SMILES notation for 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene?
The canonical SMILES for 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene is COc1cc(OC)c2c(c1)C(C)(C)c1cc(F)ccc1-2.
What is the InChIKey of 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene?
The InChIKey is IVEHGMLXEVTQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO2/c1-17(2)13-7-10(18)5-6-12(13)16-14(17)8-11(19-3)9-15(16)20-4/h5-9H,1-4H3.
What are the key properties of 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene?
7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene has a molecular weight of 272.32 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2,4-dimethoxy-9,9-dimethylfluorene is sourced from PubChem (CID 147991606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).