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Home > Aldehydes > 537033-61-7
537033-61-7 | 4-Chloro-2,3,6-trifluorobenzaldehyde
CAS No: 537033-61-7 Catalog No: AG01EWDX MDL No:MFCD03094473
Product Description
Catalog Number:
AG01EWDX
Chemical Name:
4-Chloro-2,3,6-trifluorobenzaldehyde
CAS Number:
537033-61-7
Molecular Formula:
C7H2ClF3O
Molecular Weight:
194.5384
MDL Number:
MFCD03094473
IUPAC Name:
4-chloro-2,3,6-trifluorobenzaldehyde
InChI:
InChI=1S/C7H2ClF3O/c8-4-1-5(9)3(2-12)6(10)7(4)11/h1-2H
InChI Key:
MOGPJYFHLFGBCR-UHFFFAOYSA-N
SMILES:
O=Cc1c(F)cc(c(c1F)F)Cl
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.975g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.537g/mol
Monoisotopic Mass:
193.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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