(2E)-3-(4-sulfamoylphenyl)prop-2-enoic acid
Basic information
- CAS
156572-77-9- Standard SMILES
NS(=O)(=O)c1ccc(/C=C/C(=O)O)cc1- InChIKey
HEDUHTUYJZYWOJ-ZZXKWVIFSA-N- Molecular formula
- C9H9NO4S
- Average molar mass
- 227.24 g/mol
- Monoisotopic mass
- 227.02522894
Names & identifiers
- Preferred name
- (2E)-3-(4-sulfamoylphenyl)prop-2-enoic acid
- IUPAC
- (E)-3-(4-sulfamoylphenyl)prop-2-enoic acid
Names & synonyms
156572-77-9(2E)-3-(4-SULFAMOYLPHENYL)PROP-2-ENOIC ACIDRefChem:396512836-449-1147723-92-0(2E)-3-[4-(aminosulfonyl)phenyl]acrylic acid3-(4-sulfamoylphenyl)prop-2-enoic acid(E)-3-(4-sulfamoylphenyl)prop-2-enoic Acid3-(4-Sulfamoylphenyl)acrylic acid(E)-3-(4-Sulfamoylphenyl)acrylic acid2-Propenoic acid, 3-[4-(aminosulfonyl)phenyl]-SCHEMBL7298160
Show more names
3-(4-Sulfamoylphenyl)acrylicacidAKOS000149752CS-0262599EN300-24277EN300-832934G20841Z2942851960
Database identifiers
- CAS
156572-77-9- PubChem CID
- 9504126
- EC Number
- 836-449-1
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 347
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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