o-tert-Butylstyrene
Basic information
- CAS
19789-35-6- Standard SMILES
C=Cc1ccccc1C(C)(C)C- InChIKey
LUECERFWADIZPD-UHFFFAOYSA-N- Molecular formula
- C12H16
- Average molar mass
- 160.25 g/mol
- Monoisotopic mass
- 160.12520051
Names & identifiers
- Preferred name
- o-tert-Butylstyrene
- IUPAC
- 1-tert-butyl-2-ethenylbenzene
- English name
- o-tert-butylstyrene
- Molecular formula
- C12H16
- Molecular weight
- 160.26
Names & synonyms
o-tert-Butylstyrene19789-35-6EINECS 243-316-6DTXSID10173496RefChem:167307DTXCID3095987243-316-61-tert-butyl-2-ethenylbenzene2-tert-butylstyrene2-t-Butyl styrene1-(1,1-Dimethylethyl)-2-ethenylbenzeneXVV7V9C8SA
Show more names
SCHEMBL2657153SCHEMBL3697442SCHEMBL15525730SCHEMBL29801228LUECERFWADIZPD-UHFFFAOYSA-NNS00026435Benzene, 1-(1,1-dimethylethyl)-2-ethenyl-EN300-1841926
Database identifiers
- CAS
19789-35-6- PubChem CID
- 88247
- DTXSID
DTXSID10173496- UNII
- XVV7V9C8SA
- EC Number
- 243-316-6
- Nikkaji
- J225.280E
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 150
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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