2-Methyl-5-nitrobenzenesulfonohydrazide
Basic information
- CAS
53516-95-3- Standard SMILES
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NN- InChIKey
KXDLQNGMGFULGI-UHFFFAOYSA-N- Molecular formula
- C7H9N3O4S
- Average molar mass
- 231.23 g/mol
- Monoisotopic mass
- 231.03137695
Overview
structure in first source
Names & identifiers
- Preferred name
- 2-Methyl-5-nitrobenzenesulfonohydrazide
- IUPAC
- 2-methyl-5-nitrobenzenesulfonohydrazide
Names & synonyms
2-methyl-5-nitrobenzenesulfonohydrazideRefChem:91006853516-95-32-methyl-5-nitro-benzenesulfonohydrazide2-methyl-5-nitrobenzene-1-sulfonohydrazideSCHEMBL3064070KXDLQNGMGFULGI-UHFFFAOYSA-NDTXSID901228365MFCD04618146AKOS008966976CS-0350632D87727
Show more names
SR-01000046386Benzenesulfonic acid, 2-methyl-5-nitro-, hydrazideSR-01000046386-1Z56939163
Database identifiers
- CAS
53516-95-3- PubChem CID
- 4201470
- DTXSID
DTXSID901228365
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 331
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Related reactions
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Compound notes
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