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Basic information
- CAS
19044-89-4- Standard SMILES
CCCN(CCC)c1c([N+](=O)[O-])cc(S(=O)(=O)NC)cc1[N+](=O)[O-]- InChIKey
SIQXMYBLKQFLEV-UHFFFAOYSA-N- Molecular formula
- C13H20N4O6S
- Average molar mass
- 360.39 g/mol
- Monoisotopic mass
- 360.11035536
Names & identifiers
- Preferred name
- Benzenesulfonamide, 4-(dipropylamino)-N-methyl-3,5-dinitro-
- IUPAC
- 4-(dipropylamino)-N-methyl-3,5-dinitrobenzenesulfonamide
Names & synonyms
19044-89-4Benzenesulfonamide, 4-(dipropylamino)-N-methyl-3,5-dinitro-CHEMBL53263SCHEMBL11673155DTXSID70439803SIQXMYBLKQFLEV-UHFFFAOYSA-N4-(dipropylamino)-N-methyl-3,5-dinitrobenzene-1-sulfonamide4-dipropylamino-N-methyl-3,5-dinitrobenzenesulfonamideN1 -methyl-3,5-dinitro-N4,N4 -dipropylsulfanilamide
Database identifiers
- CAS
19044-89-4- PubChem CID
- 10428592
- DTXSID
DTXSID70439803- ChEMBL
CHEMBL53263- Nikkaji
- J911.226J
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 508
Related reactions
6 records
Compound notes
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