4-(4-Fluorobenzamido)benzene-1-sulfonyl chloride
Basic information
- CAS
1016713-31-7- Standard SMILES
O=C(Nc1ccc(S(=O)(=O)Cl)cc1)c1ccc(F)cc1- InChIKey
KXFCDHAFJMTJLI-UHFFFAOYSA-N- Molecular formula
- C13H9ClFNO3S
- Average molar mass
- 313.73 g/mol
- Monoisotopic mass
- 312.9975702
Names & identifiers
- Preferred name
- 4-(4-Fluorobenzamido)benzene-1-sulfonyl chloride
- IUPAC
- 4-[(4-fluorobenzoyl)amino]benzenesulfonyl chloride
- English name
- 4-(4-Fluorobenzamido)benzene-1-sulfonyl Chloride
- Molecular formula
- C13H9ClFNO3S
- Molecular weight
- 313.73
Names & synonyms
4-(4-fluorobenzamido)benzene-1-sulfonyl chloride1016713-31-7RefChem:514185869-639-84-[(4-fluorobenzene)amido]benzene-1-sulfonyl chloride4-[(4-fluorobenzoyl)amino]benzenesulfonyl chlorideMFCD09816176C13H9ClFNO3S4-(4-FLUOROBENZAMIDO)BENZENESULFONYL CHLORIDERQB71331AKOS000156390EN300-54311
Show more names
Benzenesulfonyl chloride, 4-[(4-fluorobenzoyl)amino]-
G375524-(4-fluorobenzamido)benzene-1-sulfonylchloride
Database identifiers
- CAS
1016713-31-7- PubChem CID
- 20117675
- EC Number
- 869-639-8
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 71.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 435
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H314-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H314-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…