2-fluoro-1-nitroso-4-phenylmethoxybenzene

C13H10FNO2 — CID 123801524

IUPAC2-fluoro-1-nitroso-4-phenylmethoxybenzene
SMILESO=Nc1ccc(OCc2ccccc2)cc1F
InChIInChI=1S/C13H10FNO2/c14-12-8-11(6-7-13(12)15-16)17-9-10-4-2-1-3-5-10/h1-8H,9H2
InChIKeyPXWFXLSKMPZCRO-UHFFFAOYSA-N
MW231.23 g/mol
LogP3.80
Rot. Bonds4

About 2-fluoro-1-nitroso-4-phenylmethoxybenzene

2-fluoro-1-nitroso-4-phenylmethoxybenzene (PubChem CID 123801524) has the molecular formula C13H10FNO2 and a molecular weight of 231.23 g/mol. Its IUPAC name is 2-fluoro-1-nitroso-4-phenylmethoxybenzene.

Molecular Properties

Compound Name2-fluoro-1-nitroso-4-phenylmethoxybenzene
PubChem CID123801524
Molecular FormulaC13H10FNO2
Molecular Weight231.23 g/mol
Exact Mass231.07
IUPAC Name2-fluoro-1-nitroso-4-phenylmethoxybenzene
SMILESO=Nc1ccc(OCc2ccccc2)cc1F
InChIInChI=1S/C13H10FNO2/c14-12-8-11(6-7-13(12)15-16)17-9-10-4-2-1-3-5-10/h1-8H,9H2
InChIKeyPXWFXLSKMPZCRO-UHFFFAOYSA-N
XLogP3.80
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.23
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-fluoro-2-iodo-4-phenylmethoxybenzene
CID 18330888
1-benzylsulfanyl-2-fluoro-4-phenylmethoxybenzene
CID 167488738
1,3-difluoro-2-methyl-5-phenylmethoxybenzene;ethane
CID 142106571
(1S)-1-(2-fluoro-4-phenylmethoxyphenyl)ethanamine
CID 107718661
methyl 2-(2-fluoro-4-phenylmethoxyphenyl)-2-oxoacetate
CID 170640428
1-(4-bromophenyl)-2-fluoro-4-phenylmethoxybenzene
CID 54462897
1-fluoro-4-[(3-phenylmethoxyphenoxy)methyl]benzene
CID 57107453
N,N-bis(2-chloroethyl)-2-fluoro-4-phenylmethoxyaniline
CID 10807218
1-bromo-2-fluoro-4-[2-fluoro-4-(2-fluoro-4-phenylmethoxyphenyl)phenyl]benzene
CID 54361131
2,6-bis(phenylmethoxy)anthracene-9,10-dione
CID 147621413
2-chloro-6-phenylmethoxynaphthalene
CID 125116795
1-(2-fluoro-5-phenylmethoxyphenyl)-2-phenylethanol
CID 83988743

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-nitroso-4-phenylmethoxybenzene?
The IUPAC name of 2-fluoro-1-nitroso-4-phenylmethoxybenzene (CID 123801524) is 2-fluoro-1-nitroso-4-phenylmethoxybenzene.
What is the SMILES notation for 2-fluoro-1-nitroso-4-phenylmethoxybenzene?
The canonical SMILES for 2-fluoro-1-nitroso-4-phenylmethoxybenzene is O=Nc1ccc(OCc2ccccc2)cc1F.
What is the InChIKey of 2-fluoro-1-nitroso-4-phenylmethoxybenzene?
The InChIKey is PXWFXLSKMPZCRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO2/c14-12-8-11(6-7-13(12)15-16)17-9-10-4-2-1-3-5-10/h1-8H,9H2.
What are the key properties of 2-fluoro-1-nitroso-4-phenylmethoxybenzene?
2-fluoro-1-nitroso-4-phenylmethoxybenzene has a molecular weight of 231.23 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-nitroso-4-phenylmethoxybenzene is sourced from PubChem (CID 123801524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).