4-Bromo-3-chlorotoluene - CAS 6627-51-6
Catalog: |
BB032958 |
Product Name: |
4-Bromo-3-chlorotoluene |
CAS: |
6627-51-6 |
Synonyms: |
1-bromo-2-chloro-4-methylbenzene; 1-bromo-2-chloro-4-methylbenzene |
IUPAC Name: | 1-bromo-2-chloro-4-methylbenzene |
Description: | 4-Bromo-3-chlorotoluene (CAS# 6627-51-6) is a useful research chemical. |
Molecular Weight: | 205.48 |
Molecular Formula: | C7H6BrCl |
Canonical SMILES: | CC1=CC(=C(C=C1)Br)Cl |
InChI: | InChI=1S/C7H6BrCl/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3 |
InChI Key: | SDTULEXOSNNGAW-UHFFFAOYSA-N |
Boiling Point: | 232.1 °C at 760 mmHg |
Density: | 1.535 g/cm3 |
MDL: | MFCD00045161 |
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-2021127397-A1 | Nitrogen heterocyclic compounds and methods of use | 20191219 |
KR-20210067944-A | Organic light emitting device | 20191129 |
KR-20210067972-A | Organic light emitting device | 20191129 |
WO-2021107743-A1 | Organic light-emitting element | 20191129 |
WO-2020219904-A1 | Heterocyclic inhibitors of tyrosine kinase | 20190425 |
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: | 3.6 |
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