2-Bromo-6-chloro-4-(trifluoromethyl)aniline - CAS 109919-26-8
Catalog: |
BB002562 |
Product Name: |
2-Bromo-6-chloro-4-(trifluoromethyl)aniline |
CAS: |
109919-26-8 |
Synonyms: |
2-bromo-6-chloro-4-(trifluoromethyl)aniline |
IUPAC Name: | 2-bromo-6-chloro-4-(trifluoromethyl)aniline |
Description: | 2-Bromo-6-chloro-4-(trifluoromethyl)aniline (CAS# 109919-26-8) is a useful research chemical. |
Molecular Weight: | 274.47 |
Molecular Formula: | C7H4BrClF3N |
Canonical SMILES: | C1=C(C=C(C(=C1Cl)N)Br)C(F)(F)F |
InChI: | InChI=1S/C7H4BrClF3N/c8-4-1-3(7(10,11)12)2-5(9)6(4)13/h1-2H,13H2 |
InChI Key: | OVJCOPVKCCJSFE-UHFFFAOYSA-N |
Boiling Point: | 71-72 ℃ (0.25 torr) |
Purity: | 95 % |
Density: | 1.789 g/cm3 |
Appearance: | Light solid brown |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD00042180 |
LogP: | 4.28470 |
GHS Hazard Statement: | H302 (11.63%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2019243533-A1 | Oga inhibitor compounds | 20180621 |
AU-2019291099-A1 | Oga inhibitor compounds | 20180621 |
CN-112313231-A | OGA inhibitor compounds | 20180621 |
EP-3810608-A1 | Oga inhibitor compounds | 20180621 |
US-2021130352-A1 | Oga inhibitor compounds | 20180621 |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 272.91677 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 272.91677 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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