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Home > Aldehydes > 138490-96-7
138490-96-7 | Benzaldehyde, 3,4-dimethoxy-2-(trifluoromethyl)-
CAS No: 138490-96-7 Catalog No: AG00199V MDL No:MFCD14705135
Product Description
Catalog Number:
AG00199V
Chemical Name:
Benzaldehyde, 3,4-dimethoxy-2-(trifluoromethyl)-
CAS Number:
138490-96-7
Molecular Formula:
C10H9F3O3
Molecular Weight:
234.1719
MDL Number:
MFCD14705135
IUPAC Name:
3,4-dimethoxy-2-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C10H9F3O3/c1-15-7-4-3-6(5-14)8(9(7)16-2)10(11,12)13/h3-5H,1-2H3
InChI Key:
RVBGIIWJLAXZGT-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1OC)C(F)(F)F)C=O
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.05g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.174g/mol
Monoisotopic Mass:
234.05g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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