3-Bromo-4-hydroxytetrahydrothiophene-1,1-dioxide
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Basic information
- CAS
20688-40-8- Standard SMILES
O=S1(=O)CC(O)C(Br)C1- InChIKey
JUROXLRSVVHUOG-UHFFFAOYSA-N- Molecular formula
- C4H7BrO3S
- Average molar mass
- 215.07 g/mol
- Monoisotopic mass
- 213.92993
Names & identifiers
- Preferred name
- 3-Bromo-4-hydroxytetrahydrothiophene-1,1-dioxide
- IUPAC
- 4-bromo-1,1-dioxothiolan-3-ol
- English name
- 3-BROMO-4-HYDROXYSULFOLANE
- Molecular formula
- C4H7BrO3S
- Molecular weight
- 215.07
Names & synonyms
35330-57-53-Bromo-4-hydroxytetrahydrothiophene-1,1-dioxideRefChem:498665660-884-43-BROMO-4-HYDROXYSULFOLANE3-bromo-4-hydroxytetrahydrothiophene 1,1-dioxideMFCD000471014-bromo-1,1-dioxothiolan-3-ol20688-40-83-bromo-4-hydroxy-1??-thiolane-1,1-dione3-Bromo-4-hydroxy-1-thiolane-1,1-dione4-bromotetrahydrothiophene-3-ol 1,1-dioxide
Show more names
IFLAB-BB F0880-00423-Bromo-4-hydroxy-1λ{6}-thiolane-1,1-dioneThiophene-3-ol, 4-bromotetrahydro-, 1,1-dioxide3-BROMO-4-HYDROXYTETRAHYDRO-1H-1LAMBDA6-THIOPHENE-1,1-DIONE
3-Bromo-4-hydroxy-1lambda~6~-thiolane-1,1-dioneF0880-0042C4H7BrO3SNSC1510004-Bromo-1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-olOTAVA-BB BB0114340061trans-4-Bromo-1,1-dioxo-tetrahydrothiphen-3-oltrans-4-bromotetrahydro-3-thiopheneol 1,1-dioxide
Database identifiers
- CAS
20688-40-8、35330-57-5- PubChem CID
- 289294
- DTXSID
DTXSID60942891- EC Number
- 188-036-4、660-884-4
Properties
Computed structural propertiesFilling in
- XLogP
- -0.4
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 192
Physicochemical properties
- Melting point
- 190 °C · 190 °C
- storage temp.
- 2 · Storage temp. 2-8°C
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 6 · GHS06,GHS08
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H331-H341
- Precautionary statements
- 201 · P201-P202-P261-P264-P270-P271-P280-P302+P352-P304+P340-P308+P313-P310-P330-P361-P403+P233-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
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 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS08
- Hazard statements
- H301-H311-H331-H341
- Precautionary statements
- P201-P202-P261-P264-P270-P271-P280-P302+P352-P304+P340-P308+P313-P310-P330-P361-P403+P233-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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