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216394-05-7 | 5-Bromo-6-chloropyridine-3-sulfonyl chloride
CAS No: 216394-05-7 Catalog No: AG003488 MDL No:MFCD01318107
Product Description
Catalog Number:
AG003488
Chemical Name:
5-Bromo-6-chloropyridine-3-sulfonyl chloride
CAS Number:
216394-05-7
Molecular Formula:
C5H2BrCl2NO2S
Molecular Weight:
290.9499
MDL Number:
MFCD01318107
IUPAC Name:
5-bromo-6-chloropyridine-3-sulfonyl chloride
InChI:
InChI=1S/C5H2BrCl2NO2S/c6-4-1-3(12(8,10)11)2-9-5(4)7/h1-2H
InChI Key:
TURGMVYIESHZBE-UHFFFAOYSA-N
SMILES:
Clc1ncc(cc1Br)S(=O)(=O)Cl
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.837g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.94g/mol
Monoisotopic Mass:
288.837g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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