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Home > Fluorides > 874919-23-0
874919-23-0 | [1,1'-Biphenyl]-2,5-diol, 4'-[4-(trifluoromethyl)phenoxy]-
CAS No: 874919-23-0 Catalog No: AG004DTL MDL No:
Product Description
Catalog Number:
AG004DTL
Chemical Name:
[1,1'-Biphenyl]-2,5-diol, 4'-[4-(trifluoromethyl)phenoxy]-
CAS Number:
874919-23-0
Molecular Formula:
C19H13F3O3
Molecular Weight:
346.2999
IUPAC Name:
2-[4-[4-(trifluoromethyl)phenoxy]phenyl]benzene-1,4-diol
InChI:
InChI=1S/C19H13F3O3/c20-19(21,22)13-3-8-16(9-4-13)25-15-6-1-12(2-7-15)17-11-14(23)5-10-18(17)24/h1-11,23-24H
InChI Key:
YOOUQEURNVXARX-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)c1ccc(cc1)Oc1ccc(cc1)C(F)(F)F)O
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.082g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
346.305g/mol
Monoisotopic Mass:
346.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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