Basic information
- CAS
4837-01-8- Standard SMILES
BrCCSc1ccccc1- InChIKey
UEFBOQYLXLEJSM-UHFFFAOYSA-N- Molecular formula
- C8H9BrS
- Average molar mass
- 217.13 g/mol
- Monoisotopic mass
- 215.96083339
Names & identifiers
- Preferred name
- ((2-Bromoethyl)thio)benzene
- IUPAC
- 2-bromoethylsulfanylbenzene
- English name
- 2-Bromoethyl phenyl sulfide
- Molecular formula
- C8H9BrS
- Molecular weight
- 217.13
Names & synonyms
4837-01-8((2-Bromoethyl)thio)benzene[(2-bromoethyl)thio]benzeneDTXSID30197497EINECS 225-422-4RefChem:389698DTXCID40119988225-422-42-Bromoethyl phenyl sulfide(2-Bromoethyl)(phenyl)sulfane2-bromoethylsulfanylbenzene[(2-Bromoethyl)sulfanyl]benzene
Show more names
Bromoethylphenylsulfide2-(Phenylthio)ethyl bromide2-BROMOETHYL PHENYL SULPHIDE(2-bromoethyl)sulfanyl]benzene
Benzene, [(2-bromoethyl)thio]-MFCD000408262-bromo-1-phenylthioethane2-BROMOETHYLPHENYLSULFIDE2-Bromoethylthiobenzene2-Phenylthioethyl bromide2-Bromoethyl phenylsulfide2-bromoethylphenyl sulphide
Database identifiers
- CAS
4837-01-8- PubChem CID
- 78553
- DTXSID
DTXSID30197497- EC Number
- 225-422-4
- Nikkaji
- J31.960K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 79.3
Physicochemical properties
- Boiling point
- 140 °C · 140 °C
- Density
- 1 · 1,44 g/cm3
- refractive index
- 1.606 · 1.6060-1.6090
- Flash point
- 140 · 140-141°C/10mm
- storage temp.
- Refrigerator
- form
- clear liquid
- color
- Colorless to Yellow
- Specific Gravity
- 1.44 · 1.44
- Water Solubility
- Insoluble in water.
- BRN
- 2206188 · 2206188
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 280 g-P305+P351+P338 · P280g-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- hs_code
- 2930909899
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319
- Precautionary statements
- P280g-P305+P351+P338
Chemistry & industry
Applications
Uses2-Bromoethyl phenyl sulfide, is used to make other chemicals as well as pharmaceutical intermediate. It is also used as a application intermediate.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers39 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
陕西缔都新材料有限公司
Related reactions
19 records
Compound notes
Loading…