3,5-Dibromopyridine-4-carbonitrile - CAS 870244-34-1
Catalog: |
BB038179 |
Product Name: |
3,5-Dibromopyridine-4-carbonitrile |
CAS: |
870244-34-1 |
Synonyms: |
3,5-dibromopyridine-4-carbonitrile |
IUPAC Name: | 3,5-dibromopyridine-4-carbonitrile |
Description: | 3,5-Dibromopyridine-4-carbonitrile (CAS# 870244-34-1) is a useful research chemical. |
Molecular Weight: | 261.90 |
Molecular Formula: | C6H2Br2N2 |
Canonical SMILES: | C1=C(C(=C(C=N1)Br)C#N)Br |
InChI: | InChI=1S/C6H2Br2N2/c7-5-2-10-3-6(8)4(5)1-9/h2-3H |
InChI Key: | FHVATNRRDOWTPX-UHFFFAOYSA-N |
Boiling Point: | 317.6 °C at 760 mmHg |
Density: | 2.19 g/cm3 |
Appearance: | White to yellow or faint beige powder or crystals |
MDL: | MFCD09263321 |
LogP: | 2.47828 |
GHS Hazard Statement: | H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]; H317 (90.48%): May cause an allergic skin reaction [Warning Sensitization, Skin]; H318 (90.48%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P272, P280, P301+P316, P302+P352, P305+P354+P338, P317, P321, P330, P333+P313, P362+P364, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
AU-2017255525-A1 | 6-aminopyridin-3-yl thiazoles as modulators of rorgammat | 20160427 |
EP-3448856-A1 | 6-aminopyridin-3-yl thiazoles as modulators of ror t | 20160427 |
JP-2019515924-A | 6-Aminopyridin-3-ylthiazole as a modulator of RORγt | 20160427 |
KR-20180135962-A | 6-Aminopyridin-3-ylthiazole | 20160427 |
TW-201803869-A | 6-aminopyridin-3-ylthiazole as a RORγT modulator | 20160427 |
Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.85642 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.85847 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 36.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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