Home Sulfos 2-methyl-1,3-dioxo-isoindoline-5-sulfonyl chloride

2-methyl-1,3-dioxo-isoindoline-5-sulfonyl chloride

CAS No.:
503469-97-4
Catalog Number:
AG019D9I
Molecular Formula:
C9H6ClNO4S
Molecular Weight:
259.6662
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Product Description
Catalog Number:
AG019D9I
Chemical Name:
2-methyl-1,3-dioxo-isoindoline-5-sulfonyl chloride
CAS Number:
503469-97-4
Molecular Formula:
C9H6ClNO4S
Molecular Weight:
259.6662
MDL Number:
MFCD08443089
IUPAC Name:
2-methyl-1,3-dioxoisoindole-5-sulfonyl chloride
InChI:
InChI=1S/C9H6ClNO4S/c1-11-8(12)6-3-2-5(16(10,14)15)4-7(6)9(11)13/h2-4H,1H3
InChI Key:
RNFAQXYDTSREKC-UHFFFAOYSA-N
SMILES:
CN1C(=O)c2c(C1=O)cc(cc2)S(=O)(=O)Cl
Properties
Complexity:
441  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.971g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.66g/mol
Monoisotopic Mass:
258.971g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties