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1337881-76-1 | 4-methylisoquinoline-8-sulfonyl chloride
CAS No: 1337881-76-1 Catalog No: AG01BXWP MDL No:MFCD22380133
Product Description
Catalog Number:
AG01BXWP
Chemical Name:
4-methylisoquinoline-8-sulfonyl chloride
CAS Number:
1337881-76-1
Molecular Formula:
C10H8ClNO2S
Molecular Weight:
241.6940
MDL Number:
MFCD22380133
IUPAC Name:
4-methylisoquinoline-8-sulfonyl chloride
InChI:
InChI=1S/C10H8ClNO2S/c1-7-5-12-6-9-8(7)3-2-4-10(9)15(11,13)14/h2-6H,1H3
InChI Key:
HNKXDDMSVNPLTL-UHFFFAOYSA-N
SMILES:
Cc1cncc2c1cccc2S(=O)(=O)Cl
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.996g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.689g/mol
Monoisotopic Mass:
240.996g/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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