Perbromophenyl methacrylate
Basic information
- CAS
18967-31-2- Standard SMILES
C=C(C)C(=O)Oc1c(Br)c(Br)c(Br)c(Br)c1Br- InChIKey
OFZRSOGEOFHZKS-UHFFFAOYSA-N- Molecular formula
- C10H5Br5O2
- Average molar mass
- 556.7 g/mol
- Monoisotopic mass
- 551.62064
Names & identifiers
- Preferred name
- Perbromophenyl methacrylate
- IUPAC
- (2,3,4,5,6-pentabromophenyl) 2-methylprop-2-enoate
- English name
- Pentabromophenyl methacrylate
- Molecular formula
- C10H5Br5O2
- Molecular weight
- 556.67
Names & synonyms
18967-31-2Perbromophenyl methacrylateEINECS 242-705-8DTXSID80172375RefChem:171601DTXCID5094866242-705-8Pentabromophenyl methacrylate(2,3,4,5,6-pentabromophenyl) 2-methylprop-2-enoatePENTABROMOPHENYLMETHACRYLATE97889-13-9SCHEMBL184148
Show more names
2-Methylpropenoic acid pentabromophenyl ester3,3-dibromo-2-[dibromo-(2-bromophenyl)methyl]-2-propenoate2-Propenoic acid, 2-methyl-, 2,3,4,5,6-pentabromophenyl ester
CHEMBL3274798OFZRSOGEOFHZKS-UHFFFAOYSA-NPentabromophenyl methacrylate, 96%MFCD00080605AKOS015913192pentabromophenyl 2-methylprop-2-enoateAS-86088DB-255913
Database identifiers
- CAS
18967-31-2- PubChem CID
- 87871
- DTXSID
DTXSID80172375- ChEMBL
CHEMBL3274798- EC Number
- 242-705-8
- Nikkaji
- J224.816F
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Melting point
- 139 · 139-141 °C (lit.)
- Boiling point
- 477.7 · 477.7±45.0 °C(Predicted)
- Density
- 2.359 · 2.359±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- InChI
- 1S/C10H5Br5O2/c1-3(2)10(16)17-9-7(14)5(12)4(11)6(13)8(9)15/h1H2,2H3
- InChIKey
- OFZRSOGEOFHZKS-UHFFFAOYSA-N
- SMILES
- CC(=C)C(=O)Oc1c(Br)c(Br)c(Br)c(Br)c1Br
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
- Xi
- Risk Statements
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 1
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-28
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesMonomer used to make high refractive index polymer for optical waveguides.
Suppliers
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Related reactions
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Compound notes
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