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Home > Fluorides > 180597-96-0
180597-96-0 | Methanesulfonic acid, 1,1,1-trifluoro-, 3-fluoropropyl ester
CAS No: 180597-96-0 Catalog No: AG00224X MDL No:
Product Description
Catalog Number:
AG00224X
Chemical Name:
Methanesulfonic acid, 1,1,1-trifluoro-, 3-fluoropropyl ester
CAS Number:
180597-96-0
Molecular Formula:
C4H6F4O3S
Molecular Weight:
210.1473
IUPAC Name:
3-fluoropropyl trifluoromethanesulfonate
InChI:
InChI=1S/C4H6F4O3S/c5-2-1-3-11-12(9,10)4(6,7)8/h1-3H2
InChI Key:
CFTZHULZUDBHPH-UHFFFAOYSA-N
SMILES:
FCCCOS(=O)(=O)C(F)(F)F
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.997g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.143g/mol
Monoisotopic Mass:
209.997g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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