Basic information
- CAS
321715-14-4- Standard SMILES
O=S(=O)(NCc1cccnc1)c1ccc(Cl)cc1- InChIKey
RQLXDFUYSXYHQP-UHFFFAOYSA-N- Molecular formula
- C12H11ClN2O2S
- Average molar mass
- 282.75 g/mol
- Monoisotopic mass
- 282.0229765
Names & identifiers
- Preferred name
- 4-chloro-N-(pyridin-3-ylmethyl)benzenesulfonamide
- IUPAC
- 4-chloro-N-(pyridin-3-ylmethyl)benzenesulfonamide
- English name
- 4-chloro-N-(pyridin-3-ylmethyl)benzenesulfonamide
- Molecular formula
- C12H11ClN2O2S
- Molecular weight
- 282.75
Names & synonyms
4-chloro-N-(pyridin-3-ylmethyl)benzenesulfonamide321715-14-44-Chloro-N-pyridin-3-ylmethyl-benzenesulfonamideF0286-0473CBMicro_018447Cambridge id 5333689Oprea1_852443Oprea1_862187MLS001207825CHEMBL1868075HMS2821O17HMS5171P04
Show more names
Benzenesulfonamide, 4-chloro-N-(3-pyridinylmethyl)-
SMSSF-0041892CCG-6432STK090071AKOS000579280SMR000514305ST010510BIM-0018276.P001UPCMLD0ENAT0503-2284:001
Database identifiers
- CAS
321715-14-4- PubChem CID
- 710402
- ChEMBL
CHEMBL1868075- EC Number
- 167-466-6
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 348
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, 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 CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers4 total
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
IFLAB-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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