(2,2-Dichloroethenyl)benzene
Basic information
- CAS
50852-77-2- Standard SMILES
ClC(Cl)=Cc1ccccc1- InChIKey
CISIJYCKDJSTMX-UHFFFAOYSA-N- Molecular formula
- C8H6Cl2
- Average molar mass
- 173.04 g/mol
- Monoisotopic mass
- 171.9846556
Names & identifiers
- Preferred name
- (2,2-Dichloroethenyl)benzene
- IUPAC
- 2,2-dichloroethenylbenzene
- English name
- 2,2-dichloroethenylbenzene
- Molecular formula
- C8H6Cl2
- Molecular weight
- 0
Names & synonyms
(2,2-DICHLOROETHENYL)BENZENERefChem:394350972-731-1Dichlorostyrene(2,2-Dichlorovinyl)benzene698-88-42,2-dichloroethenylbenzene50852-77-2Benzene, dichloroethenyl-1,1-Dichloro-2-phenylethene(2,2-Dichloroethenyl)-benzeneTCC3FUW751
Show more names
beta,beta-dichlorostyreneStyrene, ar,ar-dichloro-UNII-TCC3FUW751Benzene, (2,2-dichloroethenyl)-?,?-DichlorostyreneSCHEMBL40189(2,2-dichloro-vinyl)-benzene(2,2-Dichlorovinyl)benzene #
Database identifiers
- CAS
50852-77-2、698-88-4- PubChem CID
- 93256
- DTXSID
DTXSID20198892- UNII
- TCC3FUW751
- EC Number
- 972-731-1
- Nikkaji
- J47.006F
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 119
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- FDA UNII
- 3 FUW751 · TCC3FUW751
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]
P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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