N4-Acetyl-N1-(2,5-xylyl)sulfanilamide
Basic information
- CAS
2158-18-1- Standard SMILES
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)ccc2C)cc1- InChIKey
MUJOHXQETRLCGF-UHFFFAOYSA-N- Molecular formula
- C16H18N2O3S
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.10381361
Names & identifiers
- Preferred name
- N4-Acetyl-N1-(2,5-xylyl)sulfanilamide
- IUPAC
- N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]acetamide
- English name
- 4'-(2,5-DiMethylphenylsulfaMoyl)acetanilide, 97%
- Molecular formula
- C16H18N2O3S
- Molecular weight
- 318.39
Names & synonyms
N4-ACETYL-N1-(2,5-XYLYL)SULFANILAMIDERefChem:831606665-078-62158-18-1N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]acetamideN-{4-[(2,5-dimethylphenyl)sulfamoyl]phenyl}acetamide4'-(2,5-Dimethylphenylsulfamoyl)acetanilideZINC251231ST50692984NSC203885CBMicro_023775MixCom6_000799
Show more names
4'-(2,5-DiMethylphenylsulfaMoyl)acetanilide, 97%Acetamide, N-[4-[[(2,5-dimethylphenyl)amino]sulfonyl]phenyl]-
Oprea1_026562Oprea1_062723DivK1c_005231DTXSID00308417CCG-10347MFCD00026153STK001906ZINC00251231
Database identifiers
- CAS
2158-18-1- PubChem CID
- 306208
- DTXSID
DTXSID00308417- EC Number
- 665-078-6
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 478
Physicochemical properties
- Density
- 1.303 · 1.303±0.06 g/cm3(Predicted)
- pka
- 9.41 · 9.41±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (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.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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