Basic information
- CAS
50702-38-0- Standard SMILES
O=S(=O)(Cl)c1cccc(I)c1- InChIKey
PFIYKHNOMGYTGR-UHFFFAOYSA-N- Molecular formula
- C6H4ClIO2S
- Average molar mass
- 302.52 g/mol
- Monoisotopic mass
- 301.86653
Names & identifiers
- Preferred name
- m-Iodobenzenesulphonyl chloride
- IUPAC
- 3-iodobenzenesulfonyl chloride
- English name
- 3-iodobenzenesulfonyl chloride
- Molecular formula
- C6H4ClIO2S
- Molecular weight
- 302.52
Names & synonyms
50702-38-03-iodobenzene-1-sulfonyl chlorideM-IODOBENZENESULPHONYL CHLORIDEDTXSID00198759RefChem:800375DTXCID10121250818-955-43-iodobenzenesulfonyl chlorideBenzenesulfonylchloride, 3-iodo-MFCD064090873-iodobenzene-1-sulfonylchlorideBenzenesulfonyl chloride, 3-iodo-
Show more names
3-iodobenzenesulfonyl chloride ISO 9001：2015 REACH
SCHEMBL4862223-iodo-benzenesulfonyl chlorideorb1985615(3-Iodophenyl)sulphonyl chloridePFIYKHNOMGYTGR-UHFFFAOYSA-NAKOS009161326BS-13459SY172922
Database identifiers
- CAS
50702-38-0- PubChem CID
- 39766
- DTXSID
DTXSID00198759- EC Number
- 818-955-4
- Nikkaji
- J1.619.653C
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 221
Physicochemical properties
- Boiling point
- 341 ℃ · 341℃
- Density
- 2.041 · 2.041
- Flash point
- 160 ℃ · 160℃
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-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
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314-H318
- Precautionary statements
- P280-P305+P351+P338-P310-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers9 total
韶远科技(上海)有限公司4000665055 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
11 records
Compound notes
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