difluoromethane;1-fluoro-4-methoxybenzene

C8H9F3O — CID 157211198

IUPACdifluoromethane;1-fluoro-4-methoxybenzene
SMILESCOc1ccc(F)cc1.FCF
InChIInChI=1S/C7H7FO.CH2F2/c1-9-7-4-2-6(8)3-5-7;2-1-3/h2-5H,1H3;1H2
InChIKeyARXFIZHTOBFFKF-UHFFFAOYSA-N
MW178.15 g/mol
LogP2.72
Rot. Bonds1

About difluoromethane;1-fluoro-4-methoxybenzene

difluoromethane;1-fluoro-4-methoxybenzene (PubChem CID 157211198) has the molecular formula C8H9F3O and a molecular weight of 178.15 g/mol. Its IUPAC name is difluoromethane;1-fluoro-4-methoxybenzene.

Molecular Properties

Compound Namedifluoromethane;1-fluoro-4-methoxybenzene
PubChem CID157211198
Molecular FormulaC8H9F3O
Molecular Weight178.15 g/mol
Exact Mass178.06
IUPAC Namedifluoromethane;1-fluoro-4-methoxybenzene
SMILESCOc1ccc(F)cc1.FCF
InChIInChI=1S/C7H7FO.CH2F2/c1-9-7-4-2-6(8)3-5-7;2-1-3/h2-5H,1H3;1H2
InChIKeyARXFIZHTOBFFKF-UHFFFAOYSA-N
XLogP2.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.15
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-4-[(4-methoxyphenyl)methylsulfanylmethyl]benzene
CID 59882027
2-(4-fluorophenyl)-2-(4-methoxyphenyl)ethanamine
CID 82023270
CID 171543141
CID 171543141
1-[2,2-difluoro-1-(4-fluorophenyl)ethenyl]-4-methoxybenzene
CID 11623099
ethane;1-fluoro-4-methoxybenzene;1-fluoro-2-methylbenzene
CID 156880455
1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene
CID 132919259
4-fluoro-N-[2-[(4-methoxyphenyl)methoxy]ethyl]aniline
CID 62599050
N'-(4-fluorophenyl)-N-(4-methoxyphenyl)oxamide
CID 44995864
N-(4-fluorophenyl)-3,5-dimethoxy-N-(4-methoxyphenyl)aniline
CID 101074590
3-(4-fluorophenyl)-1-(4-methoxyphenyl)propan-1-one
CID 11586950
N-[2-[[2-(4-fluorophenyl)acetyl]amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 108538633
4-fluoro-2-[2-(4-methoxyphenyl)ethoxy]aniline
CID 65431768

Frequently Asked Questions

What is the IUPAC name of difluoromethane;1-fluoro-4-methoxybenzene?
The IUPAC name of difluoromethane;1-fluoro-4-methoxybenzene (CID 157211198) is difluoromethane;1-fluoro-4-methoxybenzene.
What is the SMILES notation for difluoromethane;1-fluoro-4-methoxybenzene?
The canonical SMILES for difluoromethane;1-fluoro-4-methoxybenzene is COc1ccc(F)cc1.FCF.
What is the InChIKey of difluoromethane;1-fluoro-4-methoxybenzene?
The InChIKey is ARXFIZHTOBFFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FO.CH2F2/c1-9-7-4-2-6(8)3-5-7;2-1-3/h2-5H,1H3;1H2.
What are the key properties of difluoromethane;1-fluoro-4-methoxybenzene?
difluoromethane;1-fluoro-4-methoxybenzene has a molecular weight of 178.15 g/mol, XLogP of 2.72, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for difluoromethane;1-fluoro-4-methoxybenzene is sourced from PubChem (CID 157211198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).