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29166-53-8 | Methanesulfonic acid, chloro-, 1,4-butanediyl ester (9CI)
CAS No: 29166-53-8 Catalog No: AG002XJF MDL No:
Product Description
Catalog Number:
AG002XJF
Chemical Name:
Methanesulfonic acid, chloro-, 1,4-butanediyl ester (9CI)
CAS Number:
29166-53-8
IUPAC Name:
4-(chloromethylsulfonyloxy)butyl chloromethanesulfonate
InChI:
InChI=1S/C6H12Cl2O6S2/c7-5-15(9,10)13-3-1-2-4-14-16(11,12)6-8/h1-6H2
InChI Key:
HCEJAMHXERWOTP-UHFFFAOYSA-N
NSC Number:
106308
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.945g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.176g/mol
Monoisotopic Mass:
313.945g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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