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36823-88-8 | 4-(Trifluoromethoxy)benzoyl chloride
CAS No: 36823-88-8 Catalog No: AG003KB2 MDL No:MFCD00052329
Product Description
Catalog Number:
AG003KB2
Chemical Name:
4-(Trifluoromethoxy)benzoyl chloride
CAS Number:
36823-88-8
Molecular Formula:
C8H4ClF3O2
Molecular Weight:
224.5644
MDL Number:
MFCD00052329
IUPAC Name:
4-(trifluoromethoxy)benzoyl chloride
InChI:
InChI=1S/C8H4ClF3O2/c9-7(13)5-1-3-6(4-2-5)14-8(10,11)12/h1-4H
InChI Key:
ZXKKOFJYPRJFIE-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.985g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.563g/mol
Monoisotopic Mass:
223.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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