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101817-80-5 | Methanesulfonic acid, 1,1-difluoro-, difluoromethyl ester
CAS No: 101817-80-5 Catalog No: AG0005MZ MDL No:
Product Description
Catalog Number:
AG0005MZ
Chemical Name:
Methanesulfonic acid, 1,1-difluoro-, difluoromethyl ester
CAS Number:
101817-80-5
Molecular Formula:
C2H2F4O3S
Molecular Weight:
182.0941
IUPAC Name:
difluoromethyl difluoromethanesulfonate
InChI:
InChI=1S/C2H2F4O3S/c3-1(4)9-10(7,8)2(5)6/h1-2H
InChI Key:
IGPXFQOUYIQWAO-UHFFFAOYSA-N
SMILES:
FC(OS(=O)(=O)C(F)F)F
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.966g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.089g/mol
Monoisotopic Mass:
181.966g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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