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497959-31-6 | 2-Hydroxy-3-(trifluoromethoxy)benzaldehyde
CAS No: 497959-31-6 Catalog No: AG003HDQ MDL No:MFCD03788527
Product Description
Catalog Number:
AG003HDQ
Chemical Name:
2-Hydroxy-3-(trifluoromethoxy)benzaldehyde
CAS Number:
497959-31-6
Molecular Formula:
C8H5F3O3
Molecular Weight:
206.1187
MDL Number:
MFCD03788527
IUPAC Name:
2-hydroxy-3-(trifluoromethoxy)benzaldehyde
InChI:
InChI=1S/C8H5F3O3/c9-8(10,11)14-6-3-1-2-5(4-12)7(6)13/h1-4,13H
InChI Key:
QKIITUNJEPEAIC-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1O)OC(F)(F)F
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.019g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.12g/mol
Monoisotopic Mass:
206.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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