Basic information
- CAS
79817-49-5- Standard SMILES
CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1- InChIKey
FAGBGCWSFWSOHI-UHFFFAOYSA-N- Molecular formula
- C14H12ClN3O5S
- Average molar mass
- 369.8 g/mol
- Monoisotopic mass
- 369.0186194
Names & identifiers
- Preferred name
- N-(4-(((4-Chloro-3-nitrophenyl)sulphonyl)amino)phenyl)acetamide
- IUPAC
- N-[4-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]acetamide
- English name
- N-[4-[[(4-chloro-3-nitrophenyl)sulphonyl]amino]phenyl]acetamide
- Molecular formula
- C14H12ClN3O5S
- Molecular weight
- 369.78
Names & synonyms
EINECS 279-279-8N-[4-[[(4-chloro-3-nitrophenyl)sulphonyl]amino]phenyl]acetamideN-(4-(((4-Chloro-3-nitrophenyl)sulphonyl)amino)phenyl)acetamideRefChem:826791279-279-879817-49-5N-[4-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]acetamideN-(4-(4-Chloro-3-nitrophenylsulfonamido)phenyl)acetamideFAGBGCWSFWSOHI-UHFFFAOYSA-NDTXSID201000758NS00062130N-[4-(4-Chloro-3-nitrobenzene-1-sulfonamido)phenyl]ethanimidic acid
Show more names
N-[4-[[(4-Chloro-3-nitrophenyl)sulfonyl]amino]phenyl]acetamideAcetamide, N-[4-[[(4-chloro-3-nitrophenyl)sulfonyl]amino]phenyl]-
N-{4-[(4-Chloro-3-nitrobenzene-1-sulfonyl)amino]phenyl}ethanimidic acid
Database identifiers
- CAS
79817-49-5
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 566
Physicochemical properties
- Melting point
- 188 · 188-190 °C
- Density
- 1.57 · 1.570±0.06 g/cm3(Predicted)
- pka
- 7.33 · 7.33±0.30(Predicted)
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (8 of 8) of all reports.
Not Classified
Aggregated GHS information provided per 8 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationREACH registered substance: N-[4-[[(4-chloro-3-nitrophenyl)sulphonyl]amino]phenyl]acetamide (EC: 279-279-8)
Hazard Classes and CategoriesNot Classified
Safety data
- REACH Registrations
- Active
Chemistry & industry
Suppliers3 total
宁波君龙新材料有限公司0574 88552218 18969899212 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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