2-Bromomesitylene - CAS 576-83-0
Catalog: |
BB029786 |
Product Name: |
2-Bromomesitylene |
CAS: |
576-83-0 |
Synonyms: |
2-bromo-1,3,5-trimethylbenzene |
IUPAC Name: | 2-bromo-1,3,5-trimethylbenzene |
Description: | 2-Bromomesitylene (CAS# 576-83-0) is a useful synthetic intermediate. It is an intermediate used to prepare Hydrogen[4-[bis(2,4,6-trimethylphenyl)phosphino]-2,3,5,6-tetrafluorophenyl]hydrobis(2,3,4,5,6-pentafluorophenyl)borate (H714510) which is a frustrated phosphonium borate for metal-free catalytic hydrogenation of imines. |
Molecular Weight: | 199.09 |
Molecular Formula: | C9H11Br |
Canonical SMILES: | CC1=CC(=C(C(=C1)C)Br)C |
InChI: | InChI=1S/C9H11Br/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,1-3H3 |
InChI Key: | RRTLQRYOJOSPEA-UHFFFAOYSA-N |
Boiling Point: | 225 °C |
Melting Point: | 2 °C |
Purity: | Min. 98.0 % |
Density: | 1.289 g/cm3 |
Appearance: | Colorless transparent liquid |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00000073 |
LogP: | 3.37430 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113355685-A | Preparation method of photoinitiator TPO raw material 2,4, 6-trisubstituted bromobenzene | 20210615 |
CN-111908998-A | Preparation method of monobromoaromatic compound | 20200812 |
CN-111793087-A | Luminescent material, delayed phosphor and organic light-emitting element | 20200515 |
CN-111548342-A | Dendritic bipolar main body material with triazine as central core, preparation method and application of dendritic bipolar main body material in organic electroluminescent device | 20200512 |
KR-20210118337-A | Photosensitive resin composition, photosensitive resin layer using the same and color filter | 20200320 |
PMID | Publication Date | Title | Journal |
22463689 | 20120411 | Replacing conventional carbon nucleophiles with electrophiles: nickel-catalyzed reductive alkylation of aryl bromides and chlorides | Journal of the American Chemical Society |
21587929 | 20100618 | Mesit-yl(2,4,6-trimeth-oxy-phen-yl)borinic acid | Acta crystallographica. Section E, Structure reports online |
19630396 | 20090819 | Bond activation, substrate addition and catalysis by an isolable two-coordinate Pd(0) bis-isocyanide monomer | Journal of the American Chemical Society |
Complexity: | 99.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.00441 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.00441 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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