1-Bromo-4-chloro-2-nitrobenzene - CAS 41513-04-6
Catalog: |
BB024900 |
Product Name: |
1-Bromo-4-chloro-2-nitrobenzene |
CAS: |
41513-04-6 |
Synonyms: |
1-bromo-4-chloro-2-nitrobenzene |
IUPAC Name: | 1-bromo-4-chloro-2-nitrobenzene |
Description: | 1-Bromo-4-chloro-2-nitrobenzene (CAS# 41513-04-6) is used in the synthesis of diindolocarbazoles used in the synthesis of ladder oligo(p-aniline)s useful in organic electronics. Also used in the synthesis of novel benzenesulfonamides for the discovery of potent cell cycle inhibitors. |
Molecular Weight: | 236.45 |
Molecular Formula: | C6H3BrClNO2 |
Canonical SMILES: | C1=CC(=C(C=C1Cl)[N+](=O)[O-])Br |
InChI: | InChI=1S/C6H3BrClNO2/c7-5-2-1-4(8)3-6(5)9(10)11/h1-3H |
InChI Key: | UKTIMFAJRPSNGR-UHFFFAOYSA-N |
Boiling Point: | 242.5 ℃ at 760 mmHg |
Melting Point: | 67-70 ℃ |
Purity: | 98 % |
Density: | 2.048 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD00024320 |
LogP: | 3.53390 |
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 |
CN-113121584-A | Heterocyclic compound and organic electroluminescent device comprising same | 20210330 |
CN-113072552-A | Beta-carboline GSK3 beta/DYRK 1A dual inhibitor, preparation method thereof and application thereof in resisting Alzheimer disease | 20210304 |
KR-20210118273-A | Novel compound and organic light emitting device comprising the same | 20200319 |
KR-20210100352-A | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20200206 |
WO-2021157684-A1 | Sulfonamide or sulfinamide compound having effect of inducing brd4 protein degradation and pharmaceutical use thereof | 20200206 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 234.90357 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 234.90357 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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