Basic information
- CAS
339102-56-6- Standard SMILES
C=CCNC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1- InChIKey
NBAKQXWVYISGED-UHFFFAOYSA-N- Molecular formula
- C17H17ClN2O3S
- Average molar mass
- 364.8 g/mol
Names & identifiers
- Preferred name
- N-allyl-2-{[(4-chlorophenyl)sulfonyl]anilino}acetamide
- IUPAC
- 2-(N-(4-chlorophenyl)sulfonylanilino)-N-prop-2-enylacetamide
- English name
- N-Allyl-2-[4-chloro(phenylsulfonyl)anilino]acetamide
- Molecular formula
- C17H17ClN2O3S
- Molecular weight
- 364.85
Names & synonyms
339102-56-6N-allyl-2-{[(4-chlorophenyl)sulfonyl]anilino}acetamide2-(N-phenyl4-chlorobenzenesulfonamido)-N-(prop-2-en-1-yl)acetamideN~2~-[(4-chlorophenyl)sulfonyl]-N~2~-phenyl-N-prop-2-en-1-ylglycinamideBionet1_001864HMS573J062-(N-(4-chlorophenyl)sulfonylanilino)-N-prop-2-enylacetamideMFCD00665369STK239661AKOS0003826168K-314SN-allyl-2-(N-(4-chlorophenyl)sulfonylanilino)acetamide
Show more names
N-Allyl-2-[4-chloro(phenylsulfonyl)anilino]acetamideAcetamide, 2-[[(4-chlorophenyl)sulfonyl]phenylamino]-N-2-propen-1-yl-
Database identifiers
- CAS
339102-56-6
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 518
Physicochemical properties
- Density
- 1.321 · 1.321±0.06 g/cm3(Predicted)
- pka
- 14.08 · 14.08±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-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
- P280-P305+P351+P338
Chemistry & industry
Suppliers4 total
Ryan Scientific, Inc.[email protected]
BIONET-INTER[email protected]
MATRIX[email protected]
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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