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1426231-94-8 | 3-Isoquinolinesulfonyl chloride
CAS No: 1426231-94-8 Catalog No: AG00HWIY MDL No:
Product Description
Catalog Number:
AG00HWIY
Chemical Name:
3-Isoquinolinesulfonyl chloride
CAS Number:
1426231-94-8
IUPAC Name:
isoquinoline-3-sulfonyl chloride
InChI:
InChI=1S/C9H6ClNO2S/c10-14(12,13)9-5-7-3-1-2-4-8(7)6-11-9/h1-6H
InChI Key:
JWPBXCYNZXJSGK-UHFFFAOYSA-N
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.981g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.662g/mol
Monoisotopic Mass:
226.981g/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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