4-Bromo-1-iodo-2-nitrobenzene - CAS 112671-42-8
Catalog: |
BB003018 |
Product Name: |
4-Bromo-1-iodo-2-nitrobenzene |
CAS: |
112671-42-8 |
Synonyms: |
4-bromo-1-iodo-2-nitrobenzene; 4-bromo-1-iodo-2-nitrobenzene |
IUPAC Name: | 4-bromo-1-iodo-2-nitrobenzene |
Description: | 4-Bromo-1-iodo-2-nitrobenzene (CAS# 112671-42-8) is a useful research chemical. |
Molecular Weight: | 327.90 |
Molecular Formula: | C6H3BrINO2 |
Canonical SMILES: | C1=CC(=C(C=C1Br)[N+](=O)[O-])I |
InChI: | InChI=1S/C6H3BrINO2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3H |
InChI Key: | XLUAZLDTZYHVSO-UHFFFAOYSA-N |
Boiling Point: | 320 °C at 760 mmHg |
Density: | 2.349 g/cm3 |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
MDL: | MFCD11505492 |
LogP: | 3.48510 |
Publication Number | Title | Priority Date |
KR-20210007026-A | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20210112 |
CN-112125873-A | Compound, hole transport material, organic electroluminescent device and display device | 20200908 |
CN-111635355-A | Compound, hole transport material and organic electroluminescent device | 20200609 |
KR-20200038232-A | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20200403 |
KR-102217079-B1 | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20200403 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 326.83919 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 326.83919 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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