2-Nitro-4-phenylsulfinylaniline

HCID 13166646
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Basic information

Standard SMILES
Nc1ccc(S(=O)c2ccccc2)cc1[N+](=O)[O-]
InChIKey
STTGLRGUSFIICC-UHFFFAOYSA-N
Molecular formula
C12H10N2O3S
Average molar mass
262.29 g/mol
Monoisotopic mass
262.04121336

Names & identifiers

Preferred name
2-Nitro-4-phenylsulfinylaniline
IUPAC
4-(benzenesulfinyl)-2-nitroaniline

Names & synonyms

SCHEMBL98089042-nitro-4-phenylsulfinylanilineSTTGLRGUSFIICC-UHFFFAOYSA-N

Database identifiers

PubChem CID
13166646

Properties

Computed structural properties

XLogP
2
Topological polar surface area
108 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
18

Related reactions

2 records
New reaction record

Compound notes

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