(4-Methanesulfonyl-2-nitro-phenyl)methyl-amine

HCID 44518858
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Basic information

Standard SMILES
CS(=O)(=O)c1ccc(CN)c([N+](=O)[O-])c1
InChIKey
LOXIMWOCVDPJRF-UHFFFAOYSA-N
Molecular formula
C8H10N2O4S
Average molar mass
230.24 g/mol

Names & identifiers

Preferred name
(4-Methanesulfonyl-2-nitro-phenyl)methyl-amine
IUPAC
(4-methylsulfonyl-2-nitrophenyl)methanamine

Names & synonyms

SCHEMBL2245970LOXIMWOCVDPJRF-UHFFFAOYSA-N(4-Methanesulfonyl-2-nitro-phenyl)methyl-amine

Database identifiers

PubChem CID
44518858

Properties

Computed structural properties

XLogP
-0.2
Topological polar surface area
114 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
15

Related reactions

1 records
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Compound notes

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