3-(5-Formyl-2-furyl)benzenesulfonamide
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Basic information
- CAS
306935-94-4- Standard SMILES
NS(=O)(=O)c1cccc(-c2ccc(C=O)o2)c1- InChIKey
ALJNYCGSRQOCAN-UHFFFAOYSA-N- Molecular formula
- C11H9NO4S
- Average molar mass
- 251.26 g/mol
- Monoisotopic mass
- 251.02522894
Names & identifiers
- Preferred name
- 3-(5-Formyl-2-furyl)benzenesulfonamide
- IUPAC
- 3-(5-formylfuran-2-yl)benzenesulfonamide
- English name
- 3-(5-FORMYL-2-FURYL)BENZENESULFONAMIDE
- Molecular formula
- C11H9NO4S
- Molecular weight
- 251.26
Names & synonyms
306935-94-43-(5-formyl-2-furyl)benzenesulfonamide3-(5-formylfuran-2-yl)benzenesulfonamideMFCD020633583-(5-Formylfur-2-yl)benzenesulphonamideBenzenesulfonamide,3-(5-formyl-2-furanyl)-CBMicro_045717Cambridge id 6102433Oprea1_093176Oprea1_301457CHEMBL212338DTXSID20352255
Show more names
TIMTEC-BB SBB0009013-(5-Formyl-2-furyl)benzenesulphonamideBenzenesulfonamide, 3-(5-formyl-2-furanyl)-5-(3-Sulphamoylphenyl)furan-2-carboxaldehyde5-[3-(Aminosulphonyl)phenyl]furan-2-carboxaldehyde5-(3-Sulphamoylphenyl)-2-furaldehyde, 5-(3-Sulphamoylphenyl)furan-2-carboxaldehyde, 2-Formyl-5-(3-sulphamoylphenyl)furan
SBB000901STK392800AKOS000414189ST013840BIM-0045605.P001CS-03595713-(5-formylfuran-2-yl)benzene-1-sulfonamide
Database identifiers
- CAS
306935-94-4- PubChem CID
- 721835
- DTXSID
DTXSID20352255- ChEMBL
CHEMBL212338
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 98.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 375
Physicochemical properties
- Boiling point
- 521.8 · 521.8±60.0 °C(Predicted)
- Density
- 1.41 · 1.410±0.06 g/cm3(Predicted)
- pka
- 10 · 10.00±0.60(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2932190090 · 2932190090
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
- hs_code
- 2932190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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