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Home > Aldehydes > 161949-80-0
161949-80-0 | Benzaldehyde, 2-chloro-5-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-
CAS No: 161949-80-0 Catalog No: AG001SJ8 MDL No:
Product Description
Catalog Number:
AG001SJ8
Chemical Name:
Benzaldehyde, 2-chloro-5-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-
CAS Number:
161949-80-0
Molecular Formula:
C13H6Cl2F3NO
Molecular Weight:
320.0940
IUPAC Name:
2-chloro-5-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]benzaldehyde
InChI:
InChI=1S/C13H6Cl2F3NO/c14-10-2-1-7(3-8(10)6-20)12-11(15)4-9(5-19-12)13(16,17)18/h1-6H
InChI Key:
ZQIDNUSXILJDHV-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1Cl)c1ncc(cc1Cl)C(F)(F)F
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.978g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.092g/mol
Monoisotopic Mass:
318.978g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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