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Home > Fluorides > 203579-41-3
203579-41-3 | 1,4-Benzenediol, 2,5-bis(trifluoromethyl)-
CAS No: 203579-41-3 Catalog No: AG0028Z6 MDL No:
Product Description
Catalog Number:
AG0028Z6
Chemical Name:
1,4-Benzenediol, 2,5-bis(trifluoromethyl)-
CAS Number:
203579-41-3
Molecular Formula:
C8H4F6O2
Molecular Weight:
246.1066
IUPAC Name:
2,5-bis(trifluoromethyl)benzene-1,4-diol
InChI:
InChI=1S/C8H4F6O2/c9-7(10,11)3-1-5(15)4(2-6(3)16)8(12,13)14/h1-2,15-16H
InChI Key:
VJCAQPWYUVNXII-UHFFFAOYSA-N
SMILES:
FC(c1cc(O)c(cc1O)C(F)(F)F)(F)F
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.012g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
246.108g/mol
Monoisotopic Mass:
246.012g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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