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Home > Aldehydes > 210039-65-9
210039-65-9 | Benzaldehyde, 2-hydroxy-5-(trifluoromethyl)-
CAS No: 210039-65-9 Catalog No: AG002KIS MDL No:MFCD16999709
Product Description
Catalog Number:
AG002KIS
Chemical Name:
Benzaldehyde, 2-hydroxy-5-(trifluoromethyl)-
CAS Number:
210039-65-9
Molecular Formula:
C8H5F3O2
Molecular Weight:
190.1193
MDL Number:
MFCD16999709
IUPAC Name:
2-hydroxy-5-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H5F3O2/c9-8(10,11)6-1-2-7(13)5(3-6)4-12/h1-4,13H
InChI Key:
BXQPCQLNANMZFL-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1O)C(F)(F)F
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.121g/mol
Monoisotopic Mass:
190.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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