200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 101221-66-3
101221-66-3 | 1-Butanone, 4,4,4-trifluoro-3-hydroxy-1-phenyl-3-(trifluoromethyl)-, 2-[4,4,4-trifluoro-3-hydroxy-1-phenyl-3-(trifluoromethyl)butylidene]hydrazone
CAS No: 101221-66-3 Catalog No: AG0003ZH MDL No:
Product Description
Catalog Number:
AG0003ZH
Chemical Name:
1-Butanone, 4,4,4-trifluoro-3-hydroxy-1-phenyl-3-(trifluoromethyl)-, 2-[4,4,4-trifluoro-3-hydroxy-1-phenyl-3-(trifluoromethyl)butylidene]hydrazone
CAS Number:
101221-66-3
Molecular Formula:
C22H16F12N2O2
Molecular Weight:
568.3555
IUPAC Name:
1,1,1-trifluoro-4-phenyl-4-[[4,4,4-trifluoro-3-hydroxy-1-phenyl-3-(trifluoromethyl)butylidene]hydrazinylidene]-2-(trifluoromethyl)butan-2-ol
InChI:
InChI=1S/C22H16F12N2O2/c23-19(24,25)17(37,20(26,27)28)11-15(13-7-3-1-4-8-13)35-36-16(14-9-5-2-6-10-14)12-18(38,21(29,30)31)22(32,33)34/h1-10,37-38H,11-12H2
InChI Key:
OCYOZXHRTYHUGG-UHFFFAOYSA-N
SMILES:
OC(C(F)(F)F)(C(F)(F)F)C/C(=N\N=C(\c1ccccc1)/CC(C(F)(F)F)(C(F)(F)F)O)/c1ccccc1
Properties
Complexity:
748
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
568.102g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
16
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
568.363g/mol
Monoisotopic Mass:
568.102g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
6.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.