1-Bromo-2,4-dimethylbenzene - CAS 583-70-0
Catalog: |
BB030020 |
Product Name: |
1-Bromo-2,4-dimethylbenzene |
CAS: |
583-70-0 |
Synonyms: |
1-bromo-2,4-dimethylbenzene |
IUPAC Name: | 1-bromo-2,4-dimethylbenzene |
Description: | 1-Bromo-2,4-dimethylbenzene (CAS# 583-70-0) is synthesized by the bromination of alkylbenzene substrates by N-bromosuccinimide. |
Molecular Weight: | 185.06 |
Molecular Formula: | C8H9Br |
Canonical SMILES: | CC1=CC(=C(C=C1)Br)C |
InChI: | InChI=1S/C8H9Br/c1-6-3-4-8(9)7(2)5-6/h3-5H,1-2H3 |
InChI Key: | YSFLQVNTBBUKEA-UHFFFAOYSA-N |
Boiling Point: | 214 ℃ |
Melting Point: | -1 ℃ |
Purity: | 95 % |
Density: | 1.37 g/cm3 |
Appearance: | Clear colorless liquid. |
Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00000071 |
LogP: | 3.06590 |
GHS Hazard Statement: | H315 (97.83%): 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 |
WO-2021105261-A1 | Trpm8 modulators | 20191129 |
WO-2021045466-A1 | Compound, core-shell dye, photosensitive resin composition including same, and color filter | 20190904 |
WO-2021028570-A1 | 2-hydroxycycloalkane-1-carbamoyl derivatives | 20190815 |
WO-2020252229-A2 | Inhibitors of sarm1 | 20190614 |
US-2020142301-A1 | Photosensitive resin composition, photosensitive resin layer using the same and color filter | 20181106 |
Complexity: | 90.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.98876 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.98876 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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