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323-79-5 | 2,2'-((3-(Trifluoromethyl)phenyl)azanediyl)diethanol
CAS No: 323-79-5 Catalog No: AG003PYK MDL No:MFCD00045980
Product Description
Catalog Number:
AG003PYK
Chemical Name:
2,2'-((3-(Trifluoromethyl)phenyl)azanediyl)diethanol
CAS Number:
323-79-5
Molecular Formula:
C11H14F3NO2
Molecular Weight:
249.2296
MDL Number:
MFCD00045980
IUPAC Name:
2-[N-(2-hydroxyethyl)-3-(trifluoromethyl)anilino]ethanol
InChI:
InChI=1S/C11H14F3NO2/c12-11(13,14)9-2-1-3-10(8-9)15(4-6-16)5-7-17/h1-3,8,16-17H,4-7H2
InChI Key:
CSXRYPPKUCHPDW-UHFFFAOYSA-N
SMILES:
OCCN(c1cccc(c1)C(F)(F)F)CCO
NSC Number:
103356
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.098g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.233g/mol
Monoisotopic Mass:
249.098g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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