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Home > Fluorides > 124428-57-5
124428-57-5 | Quinazoline, 8-fluoro-4-[2-[3-(trifluoromethyl)phenyl]ethoxy]-
CAS No: 124428-57-5 Catalog No: AG000LZT MDL No:
Product Description
Catalog Number:
AG000LZT
Chemical Name:
Quinazoline, 8-fluoro-4-[2-[3-(trifluoromethyl)phenyl]ethoxy]-
CAS Number:
124428-57-5
Molecular Formula:
C17H12F4N2O
Molecular Weight:
336.2836
IUPAC Name:
8-fluoro-4-[2-[3-(trifluoromethyl)phenyl]ethoxy]quinazoline
InChI:
InChI=1S/C17H12F4N2O/c18-14-6-2-5-13-15(14)22-10-23-16(13)24-8-7-11-3-1-4-12(9-11)17(19,20)21/h1-6,9-10H,7-8H2
InChI Key:
XANDTBFGPGDVSK-UHFFFAOYSA-N
SMILES:
Fc1cccc2c1ncnc2OCCc1cccc(c1)C(F)(F)F
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.089g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.29g/mol
Monoisotopic Mass:
336.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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