4-Chloro-N-((3-nitro-phenylamino)-phenyl-methylene)-benzenesulfonamide
Basic information
- CAS
31790-00-8- Standard SMILES
O=[N+]([O-])c1cccc(N/C(=N/S(=O)(=O)c2ccc(Cl)cc2)c2ccccc2)c1- InChIKey
CPTAQAUPTREQER-UHFFFAOYSA-N- Molecular formula
- C19H14ClN3O4S
- Average molar mass
- 415.9 g/mol
- Monoisotopic mass
- 415.0393548
Names & identifiers
- Preferred name
- 4-Chloro-N-((3-nitro-phenylamino)-phenyl-methylene)-benzenesulfonamide
- IUPAC
- N'-(4-chlorophenyl)sulfonyl-N-(3-nitrophenyl)benzenecarboximidamide
- English name
- 4-Chloro-N-((3-nitro-phenylamino)-phenyl-methylene)-benzenesulfonamide
- Molecular formula
- C19H14ClN3O4S
- Molecular weight
- 415.85
Names & synonyms
31790-00-84-CHLORO-N-((3-NITRO-PHENYLAMINO)-PHENYL-METHYLENE)-BENZENESULFONAMIDERefChem:521790651-345-4(E)-N'-(4-CHLOROBENZENESULFONYL)-N-(3-NITROPHENYL)BENZENECARBOXIMIDAMIDE(E)-N'-((4-chlorophenyl)sulfonyl)-N-(3-nitrophenyl)benzimidamideN'-(4-chlorophenyl)sulfonyl-N-(3-nitrophenyl)benzenecarboximidamideAKOS016874574BIM-0006080.P001SR-01000214630SR-01000214630-1Z56754283
Show more names
(E)-N-((4-chlorophenyl)sulfonyl)-N-(3-nitrophenyl)benzimidamideBenzenecarboximidamide, N-[(4-chlorophenyl)sulfonyl]-N'-(3-nitrophenyl)-
F0898-0113
Database identifiers
- CAS
31790-00-8- PubChem CID
- 6243773
- EC Number
- 651-345-4
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 660
Physicochemical properties
- Boiling point
- 588.649 · 588.649±60.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.399 · 1.399±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 1.107 · 1.107±0.40(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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