4-Bromo-2-chlorotoluene - CAS 89794-02-5
Catalog: |
BB039600 |
Product Name: |
4-Bromo-2-chlorotoluene |
CAS: |
89794-02-5 |
Synonyms: |
4-bromo-2-chloro-1-methylbenzene |
IUPAC Name: | 4-bromo-2-chloro-1-methylbenzene |
Description: | 4-Bromo-2-chlorotoluene (CAS# 89794-02-5) is a useful research chemical. |
Molecular Weight: | 205.48 |
Molecular Formula: | C7H6BrCl |
Canonical SMILES: | CC1=C(C=C(C=C1)Br)Cl |
InChI: | InChI=1S/C7H6BrCl/c1-5-2-3-6(8)4-7(5)9/h2-4H,1H3 |
InChI Key: | LIFMTDJMLRECMX-UHFFFAOYSA-N |
Boiling Point: | 220.5 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.535 g/cm3 |
Appearance: | Clear pale yellow liquid |
MDL: | MFCD00060651 |
LogP: | 3.41090 |
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 |
WO-2021191384-A1 | Aryl piperidines as monoacylglycerol lipase modulators | 20200326 |
US-2021253565-A1 | Monoacylglycerol lipase modulators | 20200210 |
WO-2021160602-A1 | Monoacylglycerol lipase modulators | 20200210 |
CN-111646997-A | Nitrogen-containing heterocyclic compound, electronic element, and electronic device | 20191231 |
CN-111004242-A | Nitrogen-containing compound, electronic component, and electronic device | 20190823 |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.93414 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.93414 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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