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Home > Fluorides > 1257664-95-1
1257664-95-1 | 2H-Pyran, tetrahydro-4-[[3-(trifluoromethyl)phenoxy]methyl]-
CAS No: 1257664-95-1 Catalog No: AG000OOF MDL No:MFCD18087719
Product Description
Catalog Number:
AG000OOF
Chemical Name:
2H-Pyran, tetrahydro-4-[[3-(trifluoromethyl)phenoxy]methyl]-
CAS Number:
1257664-95-1
Molecular Formula:
C13H15F3O2
Molecular Weight:
260.2522
MDL Number:
MFCD18087719
IUPAC Name:
4-[[3-(trifluoromethyl)phenoxy]methyl]oxane
InChI:
InChI=1S/C13H15F3O2/c14-13(15,16)11-2-1-3-12(8-11)18-9-10-4-6-17-7-5-10/h1-3,8,10H,4-7,9H2
InChI Key:
JXLRDUQXXKNUBR-UHFFFAOYSA-N
SMILES:
FC(c1cccc(c1)OCC1CCOCC1)(F)F
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.102g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.256g/mol
Monoisotopic Mass:
260.102g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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