2-Bromo-6-nitro-4-(trifluoromethyl)aniline - CAS 113170-71-1
Catalog: |
BB003134 |
Product Name: |
2-Bromo-6-nitro-4-(trifluoromethyl)aniline |
CAS: |
113170-71-1 |
Synonyms: |
2-bromo-6-nitro-4-(trifluoromethyl)aniline |
IUPAC Name: | 2-bromo-6-nitro-4-(trifluoromethyl)aniline |
Description: | 2-Bromo-6-nitro-4-(trifluoromethyl)aniline (CAS# 113170-71-1) is a useful research chemical. |
Molecular Weight: | 285.02 |
Molecular Formula: | C7H4BrF3N2O2 |
Canonical SMILES: | C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)C(F)(F)F |
InChI: | InChI=1S/C7H4BrF3N2O2/c8-4-1-3(7(9,10)11)2-5(6(4)12)13(14)15/h1-2H,12H2 |
InChI Key: | ZUZMWPRSGJTLHW-UHFFFAOYSA-N |
Boiling Point: | 278.3 ℃ at 760 mmHg |
Purity: | 98 % |
Density: | 1.859 g/cm3 |
Appearance: | Solid |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD00042151 |
LogP: | 4.06270 |
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-2011112731-A2 | Heterocyclic inhibitors of histamine receptors for the treatment of disease | 20100310 |
US-2011257137-A1 | Heterocyclic inhibitors of histamine receptors for the treatment of disease | 20080910 |
EP-3210609-A1 | Phosphorous derivatives as kinase inhibitors | 20080521 |
US-2012202776-A1 | Phosphorus derivatives as kinase inhibitors | 20080521 |
US-2013225527-A1 | Phosphorus Derivatives as Kinase Inhibitors | 20080521 |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 283.94082 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 283.94082 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS