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Home > Aldehydes > 1261442-48-1
1261442-48-1 | Benzaldehyde, 4-chloro-2-(trifluoromethoxy)-
CAS No: 1261442-48-1 Catalog No: AG000RRI MDL No:MFCD18393772
Product Description
Catalog Number:
AG000RRI
Chemical Name:
Benzaldehyde, 4-chloro-2-(trifluoromethoxy)-
CAS Number:
1261442-48-1
Molecular Formula:
C8H4ClF3O2
Molecular Weight:
224.5644
MDL Number:
MFCD18393772
IUPAC Name:
4-chloro-2-(trifluoromethoxy)benzaldehyde
InChI:
InChI=1S/C8H4ClF3O2/c9-6-2-1-5(4-13)7(3-6)14-8(10,11)12/h1-4H
InChI Key:
SONFEJGLHKNKEF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1OC(F)(F)F)Cl
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.985g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.563g/mol
Monoisotopic Mass:
223.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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