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19161-44-5 | "2,3,5,6-tetrafluoro-4-methoxybenzaldehyde"
CAS No: 19161-44-5 Catalog No: AG01FN16 MDL No:MFCD25960513
Product Description
Catalog Number:
AG01FN16
Chemical Name:
"2,3,5,6-tetrafluoro-4-methoxybenzaldehyde"
CAS Number:
19161-44-5
Molecular Formula:
C8H4F4O2
Molecular Weight:
208.1098
MDL Number:
MFCD25960513
IUPAC Name:
2,3,5,6-tetrafluoro-4-methoxybenzaldehyde
InChI:
InChI=1S/C8H4F4O2/c1-14-8-6(11)4(9)3(2-13)5(10)7(8)12/h2H,1H3
InChI Key:
PCZBUBRBHGQWCL-UHFFFAOYSA-N
SMILES:
COc1c(F)c(F)c(c(c1F)F)C=O
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.015g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.112g/mol
Monoisotopic Mass:
208.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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