Basic information
- CAS
379254-58-7- Standard SMILES
CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)O)c1- InChIKey
OQZORFCSUZSIDR-UHFFFAOYSA-N- Molecular formula
- C14H11ClFNO4S
- Average molar mass
- 343.8 g/mol
- Monoisotopic mass
- 343.0081349
Names & identifiers
- Preferred name
- 2-Chloro-5-[(4-fluoro-phenyl)-methyl-sulfamoyl]-benzoic acid
- IUPAC
- 2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]benzoic acid
- English name
- 2-CHLORO-5-[(4-FLUORO-PHENYL)-METHYL-SULFAMOYL]-BENZOIC ACID
- Molecular formula
- C14H11ClFNO4S
- Molecular weight
- 343.76
Names & synonyms
379254-58-72-Chloro-5-[(4-fluoro-phenyl)-methyl-sulfamoyl]-benzoic acid2-chloro-5-[(4-fluorophenyl)(methyl)sulfamoyl]benzoic acid2-Chloro-5-(N-(4-fluorophenyl)-N-methylsulfamoyl)benzoic acidMFCD031472732-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]benzoic acid2-Chloro-5-[N-(4-fluorophenyl)-N-methylsulfamoyl]benzoic Acid2-chloro-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoic AcidAKOS000115001SY132935CS-0218285EN300-00515
Show more names
2-Chloro-5-[[(4-fluorophenyl)methylamino]sulfonyl]benzoic acidBenzoic acid, 2-chloro-5-[[(4-fluorophenyl)methylamino]sulfonyl]-
G31586F641446Z568623792-Chloro-5-(N-(4-fluorophenyl)-N-methylsulfamoyl)benzoicacid
Database identifiers
- CAS
379254-58-7
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 501
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers4 total
西安峥鎏生物科技有限公司15594552852 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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