Basic information
- CAS
68379-05-5- Standard SMILES
NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]- InChIKey
KDOWETFJBFGOOG-UHFFFAOYSA-N- Molecular formula
- C6H5ClN2O4S
- Average molar mass
- 236.63 g/mol
- Monoisotopic mass
- 235.9658555
Names & identifiers
- Preferred name
- 5-Chloro-2-nitrobenzenesulfonamide
- IUPAC
- 5-chloro-2-nitrobenzenesulfonamide
- English name
- 5-chloro-2-nitrobenzene-1-sulfonaMide
- Molecular formula
- C6H5ClN2O4S
- Molecular weight
- 236.63
Names & synonyms
5-Chloro-2-nitrobenzenesulfonamide68379-05-5DTXSID60346577RefChem:302449DTXCID90297649KDOWETFJBFGOOG-UHFFFAOYSA-N5-chloro-2-nitrobenzene-1-sulfonamideMFCD027069165-Chlor-2-nitrobenzolsulfamidSCHEMBL21299195-chloro-2-nitro-benzenesulfonamideTCA37905
Show more names
2-Nitro-5-chlorobenzenesulfonamideBenzenesulfonamide, 5-chloro-2-nitro-
AKOS008966361AS-40458DB-332904CS-0232517EN300-127410F231965SR-01000028986SR-01000028986-1
Database identifiers
- CAS
68379-05-5- PubChem CID
- 613355
- DTXSID
DTXSID60346577
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 320
Physicochemical properties
- Melting point
- 159 · 159-160 °C
- Boiling point
- 450.9 · 450.9±55.0 °C(Predicted)
- Density
- 1.664 · 1.664±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 8.98 · 8.98±0.60(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers8 total
武汉杂环科技有限公司027-88041443 13072715837 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
苏州华诺医药有限公司0512-6956-1983 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海齐奥化工科技有限公司021-58892003 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…