2-Fluoro-6-[(3-methoxyphenyl)sulfonyl]benzonitrile

HCID 10582540
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Basic information

Standard SMILES
COc1cccc(S(=O)(=O)c2cccc(F)c2C#N)c1
InChIKey
MSGFCYJYWWHMFD-UHFFFAOYSA-N
Molecular formula
C14H10FNO3S
Average molar mass
291.3 g/mol

Names & identifiers

Preferred name
2-Fluoro-6-[(3-methoxyphenyl)sulfonyl]benzonitrile
IUPAC
2-fluoro-6-(3-methoxyphenyl)sulfonylbenzonitrile

Names & synonyms

SCHEMBL8410402MSGFCYJYWWHMFD-UHFFFAOYSA-N2-Fluoro-6-[(3 -methoxyphenyl)sulfonyl]benzonitrile

Database identifiers

PubChem CID
10582540

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
75.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
20

Related reactions

4 records
New reaction record

Linked notes

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