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2342-67-8 | 1-Propanol, 3,3,3-trifluoro-, 1-(4-methylbenzenesulfonate)
CAS No: 2342-67-8 Catalog No: AG002N6S MDL No:MFCD16620595
Product Description
Catalog Number:
AG002N6S
Chemical Name:
1-Propanol, 3,3,3-trifluoro-, 1-(4-methylbenzenesulfonate)
CAS Number:
2342-67-8
MDL Number:
MFCD16620595
IUPAC Name:
3,3,3-trifluoropropyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C10H11F3O3S/c1-8-2-4-9(5-3-8)17(14,15)16-7-6-10(11,12)13/h2-5H,6-7H2,1H3
InChI Key:
XQTHZBKUIVFAST-UHFFFAOYSA-N
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.038g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.25g/mol
Monoisotopic Mass:
268.038g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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