5-Bromo-N,N-dimethyl-3-nitropyridin-2-amine - CAS 1040682-46-9
Catalog: |
BB001318 |
Product Name: |
5-Bromo-N,N-dimethyl-3-nitropyridin-2-amine |
CAS: |
1040682-46-9 |
Synonyms: |
5-bromo-N,N-dimethyl-3-nitropyridin-2-amine |
IUPAC Name: | 5-bromo-N,N-dimethyl-3-nitropyridin-2-amine |
Description: | 5-Bromo-N,N-dimethyl-3-nitropyridin-2-amine (CAS# 1040682-46-9) is a useful research chemical. |
Molecular Weight: | 246.06 |
Molecular Formula: | C7H8BrN3O2 |
Canonical SMILES: | CN(C)C1=NC=C(C=C1[N+](=O)[O-])Br |
InChI: | InChI=1S/C7H8BrN3O2/c1-10(2)7-6(11(12)13)3-5(8)4-9-7/h3-4H,1-2H3 |
InChI Key: | SZNVATVPNHSUOD-UHFFFAOYSA-N |
Purity: | 95 % |
Appearance: | Solid |
MDL: | MFCD10574977 |
LogP: | 2.34150 |
Publication Number | Title | Priority Date |
EP-3094326-A1 | Heteroaryls and uses thereof | 20140114 |
JP-2017502092-A | Heteroaryl and uses thereof | 20140114 |
US-10202373-B2 | Heteroaryls and uses thereof | 20140114 |
US-2016333007-A1 | Heteroaryls and uses thereof | 20140114 |
WO-2015108881-A1 | Heteroaryls and uses thereof | 20140114 |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.97999 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.97999 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 62 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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