The store will not work correctly when cookies are disabled.
4-Bromo-3-chlorobenzotrifluoride - 98%, high purity , CAS No.402-04-0
Basic Description
Synonyms | 4-Bromo-3-chlorobenzotrifluoride | 402-04-0 | 1-Bromo-2-chloro-4-trifluoromethylbenzene | 1-bromo-2-chloro-4-(trifluoromethyl)benzene | MFCD00673985 | BENZENE, 1-BROMO-2-CHLORO-4-(TRIFLUOROMETHYL)- | SCHEMBL1460004 | DTXSID30558307 | 2-Chloro-4-trifluoromethylbromobenzen |
Specifications & Purity | ≥98% |
Shipped In | Normal |
---|
Names and Identifiers
Pubchem Sid | 488198625 |
Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488198625 |
IUPAC Name | 1-bromo-2-chloro-4-(trifluoromethyl)benzene |
INCHI | InChI=1S/C7H3BrClF3/c8-5-2-1-4(3-6(5)9)7(10,11)12/h1-3H |
InChi Key | RVTIHGGJJMXISV-UHFFFAOYSA-N |
Canonical SMILES | C1=CC(=C(C=C1C(F)(F)F)Cl)Br |
Isomeric SMILES | C1=CC(=C(C=C1C(F)(F)F)Cl)Br |
PubChem CID | 14273266 |
Molecular Weight | 259.45 |
---|
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight | 259.450 g/mol |
---|
XLogP3 | 4.100 |
---|
Hydrogen Bond Donor Count | 0 |
---|
Hydrogen Bond Acceptor Count | 3 |
---|
Rotatable Bond Count | 0 |
---|
Exact Mass | 257.906 Da |
---|
Monoisotopic Mass | 257.906 Da |
---|
Topological Polar Surface Area | 0.000 Ų |
---|
Heavy Atom Count | 12 |
---|
Formal Charge | 0 |
---|
Complexity | 159.000 |
---|
Isotope Atom Count | 0 |
---|
Defined Atom Stereocenter Count | 0 |
---|
Undefined Atom Stereocenter Count | 0 |
---|
Defined Bond Stereocenter Count | 0 |
---|
Undefined Bond Stereocenter Count | 0 |
---|
The total count of all stereochemical bonds | 0 |
---|
Covalently-Bonded Unit Count | 1 |
---|
Safety and Hazards(GHS)
Pictogram(s) | GHS07 |
Signal | Warning |
Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation |
Precautionary Statements | P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell. |
---|
Solution Calculators
Molarity Calculator
Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator
Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator