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85477-01-6 | Benzenesulfonyl chloride, 2,4,5-trimethoxy-
CAS No: 85477-01-6 Catalog No: AG004N8Q MDL No:MFCD21875818
Product Description
Catalog Number:
AG004N8Q
Chemical Name:
Benzenesulfonyl chloride, 2,4,5-trimethoxy-
CAS Number:
85477-01-6
Molecular Formula:
C9H11ClO5S
Molecular Weight:
266.6986
MDL Number:
MFCD21875818
IUPAC Name:
2,4,5-trimethoxybenzenesulfonyl chloride
InChI:
InChI=1S/C9H11ClO5S/c1-13-6-4-8(15-3)9(16(10,11)12)5-7(6)14-2/h4-5H,1-3H3
InChI Key:
LSFOYENWQJZHKY-UHFFFAOYSA-N
SMILES:
COc1cc(c(cc1OC)OC)S(=O)(=O)Cl
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.002g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.692g/mol
Monoisotopic Mass:
266.002g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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