Home Sulfos 3-Methylisoquinoline-5-sulfonyl chloride

3-Methylisoquinoline-5-sulfonyl chloride

CAS No.:
640290-02-4
Catalog Number:
AG00EDA6
Molecular Formula:
C10H8ClNO2S
Molecular Weight:
241.6940
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Product Description
Catalog Number:
AG00EDA6
Chemical Name:
3-Methylisoquinoline-5-sulfonyl chloride
CAS Number:
640290-02-4
Molecular Formula:
C10H8ClNO2S
Molecular Weight:
241.6940
MDL Number:
MFCD11052648
IUPAC Name:
3-methylisoquinoline-5-sulfonyl chloride
InChI:
InChI=1S/C10H8ClNO2S/c1-7-5-9-8(6-12-7)3-2-4-10(9)15(11,13)14/h2-6H,1H3
InChI Key:
QLIQMMPZJXCVPK-UHFFFAOYSA-N
SMILES:
Cc1ncc2c(c1)c(ccc2)S(=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  
Properties