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Home > Aldehydes > 886503-52-2
886503-52-2 | 2-Trifluoromethoxy-4-methoxybenzaldehyde
CAS No: 886503-52-2 Catalog No: AG008A4L MDL No:MFCD06660317
Product Description
Catalog Number:
AG008A4L
Chemical Name:
2-Trifluoromethoxy-4-methoxybenzaldehyde
CAS Number:
886503-52-2
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
MDL Number:
MFCD06660317
IUPAC Name:
4-methoxy-2-(trifluoromethoxy)benzaldehyde
InChI:
InChI=1S/C9H7F3O3/c1-14-7-3-2-6(5-13)8(4-7)15-9(10,11)12/h2-5H,1H3
InChI Key:
NPUIWDQXZDLZIM-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC(F)(F)F)C=O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.035g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.147g/mol
Monoisotopic Mass:
220.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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