2,4-Bis-(methylsulfonyl)-1-chlorobenzene
Basic information
- CAS
17481-98-0- Standard SMILES
CS(=O)(=O)c1ccc(Cl)c(S(C)(=O)=O)c1- InChIKey
UKDQQMUWOMVLCG-UHFFFAOYSA-N- Molecular formula
- C8H9ClO4S2
- Average molar mass
- 268.7 g/mol
- Monoisotopic mass
- 267.9630788
Names & identifiers
- Preferred name
- 2,4-Bis-(methylsulfonyl)-1-chlorobenzene
- IUPAC
- 1-chloro-2,4-bis(methylsulfonyl)benzene
- English name
- 1-Chloro-2,4-bis-methanesulfonyl-benzene
- Molecular formula
- C8H9ClO4S2
- Molecular weight
- 268.74
Names & synonyms
2,4-BIS-(METHYLSULFONYL)-1-CHLOROBENZENERefChem:443093654-120-917481-98-01-chloro-2,4-dimethanesulfonylbenzene1-Chloro-2,4-bis(methylsulfonyl)benzene1-Chloro-2,4-bis-methanesulfonyl-benzeneBenzene, 1-chloro-2,4-bis(methylsulfonyl)-1-Chloro-2,4-di(methanesulfonyl)benzeneChemDiv2_000195SCHEMBL5733156DTXSID80346115
Show more names
HMS1369I192,4-bismethanesulfonylchlorobenzeneSAA48198AKOS000115070CCG-1032351-Chloro-2,4-bis(methylsulfonyl)benzene #DB-4076801-chloro-2,4,6-bis-(methylsulfonyl)benzene
Database identifiers
- CAS
17481-98-0- PubChem CID
- 609765
- DTXSID
DTXSID80346115- EC Number
- 654-120-9
- Nikkaji
- J124.156G
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 415
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2A (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Related reactions
1 records
Compound notes
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