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155908-58-0 | 3-(2,2,2-trifluoroethoxy)benzaldehyde
CAS No: 155908-58-0 Catalog No: AG00B8U7 MDL No:MFCD07432793
Product Description
Catalog Number:
AG00B8U7
Chemical Name:
3-(2,2,2-trifluoroethoxy)benzaldehyde
CAS Number:
155908-58-0
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
MDL Number:
MFCD07432793
IUPAC Name:
3-(2,2,2-trifluoroethoxy)benzaldehyde
InChI:
InChI=1S/C9H7F3O2/c10-9(11,12)6-14-8-3-1-2-7(4-8)5-13/h1-5H,6H2
InChI Key:
VXNUKVSIHDRZRA-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCC(F)(F)F
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.148g/mol
Monoisotopic Mass:
204.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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