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Home > Fluorides > 113845-69-5
113845-69-5 | Morpholine, 4-[4-(trifluoromethyl)phenyl]-
CAS No: 113845-69-5 Catalog No: AG0009VQ MDL No:
Product Description
Catalog Number:
AG0009VQ
Chemical Name:
Morpholine, 4-[4-(trifluoromethyl)phenyl]-
CAS Number:
113845-69-5
Molecular Formula:
C11H12F3NO
Molecular Weight:
231.2143
IUPAC Name:
4-[4-(trifluoromethyl)phenyl]morpholine
InChI:
InChI=1S/C11H12F3NO/c12-11(13,14)9-1-3-10(4-2-9)15-5-7-16-8-6-15/h1-4H,5-8H2
InChI Key:
NWFCNOTUONSUHM-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)N1CCOCC1)(F)F
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.087g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.218g/mol
Monoisotopic Mass:
231.087g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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