2-(Tribromomethanesulfonyl)pyridine - CAS 59626-33-4
Catalog: |
BB030440 |
Product Name: |
2-(Tribromomethanesulfonyl)pyridine |
CAS: |
59626-33-4 |
Synonyms: |
2-(tribromomethylsulfonyl)pyridine; 2-(tribromomethylsulfonyl)pyridine |
IUPAC Name: | 2-(tribromomethylsulfonyl)pyridine |
Description: | 2-(Tribromomethanesulfonyl)pyridine (CAS# 59626-33-4) is a useful research chemical. |
Molecular Weight: | 393.88 |
Molecular Formula: | C6H4Br3NO2S |
Canonical SMILES: | C1=CC=NC(=C1)S(=O)(=O)C(Br)(Br)Br |
InChI: | InChI=1S/C6H4Br3NO2S/c7-6(8,9)13(11,12)5-3-1-2-4-10-5/h1-4H |
InChI Key: | FRCQMXHPNJVPJC-UHFFFAOYSA-N |
Boiling Point: | 400.7 °C at 760 mmHg |
Density: | 2.401 g/cm3 |
Solubility: | Other solvents(Soluble) : Acetone, Acetonitrile |
Appearance: | White crystalline powder |
MDL: | MFCD02093493 |
LogP: | 3.73210 |
GHS Hazard Statement: | H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 392.74924 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 390.75129 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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