Home Sulfos 1-Chloroisoquinoline-5-sulfonyl chloride

1-Chloroisoquinoline-5-sulfonyl chloride

CAS No.:
141519-77-9
Catalog Number:
AG001GIT
Molecular Formula:
C9H5Cl2NO2S
Molecular Weight:
262.1125
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Product Description
Catalog Number:
AG001GIT
Chemical Name:
1-Chloroisoquinoline-5-sulfonyl chloride
CAS Number:
141519-77-9
Molecular Formula:
C9H5Cl2NO2S
Molecular Weight:
262.1125
MDL Number:
MFCD11052630
IUPAC Name:
1-chloroisoquinoline-5-sulfonyl chloride
InChI:
InChI=1S/C9H5Cl2NO2S/c10-9-7-2-1-3-8(15(11,13)14)6(7)4-5-12-9/h1-5H
InChI Key:
LAFGPNHTRJDGQR-UHFFFAOYSA-N
SMILES:
Clc1nccc2c1cccc2S(=O)(=O)Cl
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.942g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.104g/mol
Monoisotopic Mass:
260.942g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties