2-Methoxycarbonyl-3-methyl-4-nitrobenzenesulfonyl chloride

HCID 15334533
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Basic information

Standard SMILES
COC(=O)c1c(S(=O)(=O)Cl)ccc([N+](=O)[O-])c1C
InChIKey
GBLHYNVHXROBTQ-UHFFFAOYSA-N
Molecular formula
C9H8ClNO6S
Average molar mass
293.68 g/mol

Names & identifiers

Preferred name
2-Methoxycarbonyl-3-methyl-4-nitrobenzenesulfonyl chloride
IUPAC
methyl 6-chlorosulfonyl-2-methyl-3-nitrobenzoate

Names & synonyms

SCHEMBL7777718GBLHYNVHXROBTQ-UHFFFAOYSA-N2-methoxycarbonyl-3-methyl-4-nitrobenzenesulfonyl chloride

Database identifiers

PubChem CID
15334533

Properties

Computed structural properties

XLogP
2
Topological polar surface area
115 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
18

Related reactions

5 records
New reaction record

Linked notes

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