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88627-40-1 | 1-Propene, 3-[[2-(2,2,2-trifluoroethoxy)ethyl]thio]-
CAS No: 88627-40-1 Catalog No: AG004AJI MDL No:
Product Description
Catalog Number:
AG004AJI
Chemical Name:
1-Propene, 3-[[2-(2,2,2-trifluoroethoxy)ethyl]thio]-
CAS Number:
88627-40-1
Molecular Formula:
C7H11F3OS
Molecular Weight:
200.2218
IUPAC Name:
3-[2-(2,2,2-trifluoroethoxy)ethylsulfanyl]prop-1-ene
InChI:
InChI=1S/C7H11F3OS/c1-2-4-12-5-3-11-6-7(8,9)10/h2H,1,3-6H2
InChI Key:
KKRRMYRLEXEFOP-UHFFFAOYSA-N
SMILES:
C=CCSCCOCC(F)(F)F
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.219g/mol
Monoisotopic Mass:
200.048g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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