Basic information
- CAS
5535-52-4- Standard SMILES
C=CS(=O)(=O)c1ccc(C)cc1- InChIKey
VZQFRPMWVXCURA-UHFFFAOYSA-N- Molecular formula
- C9H10O2S
- Average molar mass
- 182.24 g/mol
- Monoisotopic mass
- 182.04015073
Names & identifiers
- Preferred name
- P-Tolyl vinyl sulfone
- IUPAC
- 1-ethenylsulfonyl-4-methylbenzene
- English name
- p-Tolyl vinyl sulphone
- Molecular formula
- C9H10O2S
- Molecular weight
- 182.24
Names & synonyms
p-Tolyl vinyl sulfoneRefChem:858244668-925-85535-52-4p-TosylethyleneBenzene, 1-(ethenylsulfonyl)-4-methyl-p-Tolylvinylsulphone1-ethenylsulfonyl-4-methylbenzenep-Tolyl vinyl sulphoneSulfone, p-tolyl vinyl1-(ethenesulfonyl)-4-methylbenzenevinyl p-tolylsulfone
Show more names
Tosylethene4-Tolyl vinyl sulphonep-Tolylvinylsulfone,98%Vinyl 4-methylphenyl sulfone4-Methylphenyl vinyl sulphone
1-(Ethenylsulfonyl)-4-methylbenzene4-tolyl vinyl sulfoneMaybridge1_0041834-Methylphenyl vinyl sulfoneSCHEMBL2889896SCHEMBL26124272HMS553G05DTXSID30203906
Database identifiers
- CAS
5535-52-4- PubChem CID
- 79665
- DTXSID
DTXSID30203906- EC Number
- 668-925-8
- Nikkaji
- J119.665K
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- Melting point
- 62 · 62-64°C
- Boiling point
- 324.1 · 324.1±25.0 °C(Predicted)
- Density
- 1.145 · 1.145±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (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 CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers5 total
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
8 records
Compound notes
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