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59626-33-4 | 2-((Tribromomethyl)sulfonyl)pyridine
CAS No: 59626-33-4 Catalog No: AG003EOK MDL No:MFCD02093493
Product Description
Catalog Number:
AG003EOK
Chemical Name:
2-((Tribromomethyl)sulfonyl)pyridine
CAS Number:
59626-33-4
Molecular Formula:
C6H4Br3NO2S
Molecular Weight:
393.8785
MDL Number:
MFCD02093493
IUPAC Name:
2-(tribromomethylsulfonyl)pyridine
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
SMILES:
O=S(=O)(C(Br)(Br)Br)c1ccccn1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.749g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
393.875g/mol
Monoisotopic Mass:
390.751g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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