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Home > Fluorides > 1713160-57-6
1713160-57-6 | 3,3,3-Trifluoropropyl 2-methoxyphenyl sulfide
CAS No: 1713160-57-6 Catalog No: AG01FAGN MDL No:MFCD25976523
Product Description
Catalog Number:
AG01FAGN
Chemical Name:
3,3,3-Trifluoropropyl 2-methoxyphenyl sulfide
CAS Number:
1713160-57-6
Molecular Formula:
C10H11F3OS
Molecular Weight:
236.2539
MDL Number:
MFCD25976523
IUPAC Name:
1-methoxy-2-(3,3,3-trifluoropropylsulfanyl)benzene
InChI:
InChI=1S/C10H11F3OS/c1-14-8-4-2-3-5-9(8)15-7-6-10(11,12)13/h2-5H,6-7H2,1H3
InChI Key:
XNGYCKHFOSTFQO-UHFFFAOYSA-N
SMILES:
COc1ccccc1SCCC(F)(F)F
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.048g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.252g/mol
Monoisotopic Mass:
236.048g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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