2-Bromo-5-iodobenzonitrile - CAS 1252046-13-1
Catalog: |
BB006094 |
Product Name: |
2-Bromo-5-iodobenzonitrile |
CAS: |
1252046-13-1 |
Synonyms: |
2-bromo-5-iodobenzonitrile; 2-bromo-5-iodobenzonitrile |
IUPAC Name: | 2-bromo-5-iodobenzonitrile |
Description: | 2-Bromo-5-iodobenzonitrile (CAS# 1252046-13-1 ) is a useful research chemical. |
Molecular Weight: | 307.91 |
Molecular Formula: | C7H3BrIN |
Canonical SMILES: | C1=CC(=C(C=C1I)C#N)Br |
InChI: | InChI=1S/C7H3BrIN/c8-7-2-1-6(9)3-5(7)4-10/h1-3H |
InChI Key: | KXTNUMXYGMBTSV-UHFFFAOYSA-N |
Appearance: | Pale-yellow to yellow-brown solid |
MDL: | MFCD09025663 |
LogP: | 2.92538 |
Publication Number | Title | Priority Date |
EP-3543230-A1 | Organic electroluminescence device and polycyclic compound for organic electroluminescence device | 20180322 |
KR-20190112231-A | Organic electroluminescence device and polycyclic compound for organic electroluminescence device | 20180322 |
US-2019296247-A1 | Organic electroluminescence device and polycyclic compound for organic electroluminescence device | 20180322 |
EP-3543230-B1 | Organic electroluminescence device and polycyclic compound for organic electroluminescence device | 20180322 |
WO-2019149657-A1 | Benzyl-, (pyridin-3-yl)methyl- or (pyridin-4-yl)methyl-substituted oxadiazolopyridine derivatives as ghrelin o-acyl transferase (goat) inhibitors | 20180202 |
Complexity: | 162 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 306.84936 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 306.84936 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 23.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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