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Home > Aldehydes > 886499-59-8
886499-59-8 | 4-CHLORO-3-(TRIFLUOROMETHOXY)BENZALDEHYDE
CAS No: 886499-59-8 Catalog No: AG00GY3J MDL No:MFCD06660219
Product Description
Catalog Number:
AG00GY3J
Chemical Name:
4-CHLORO-3-(TRIFLUOROMETHOXY)BENZALDEHYDE
CAS Number:
886499-59-8
Molecular Formula:
C8H4ClF3O2
Molecular Weight:
224.5644
MDL Number:
MFCD06660219
IUPAC Name:
4-chloro-3-(trifluoromethoxy)benzaldehyde
InChI:
InChI=1S/C8H4ClF3O2/c9-6-2-1-5(4-13)3-7(6)14-8(10,11)12/h1-4H
InChI Key:
XOHOCMBXDFQWDF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)OC(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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