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1060805-47-1 | 6-chloro-4-(trifluoromethyl)pyridine-2-carbaldehyde
CAS No: 1060805-47-1 Catalog No: AG01BTJR MDL No:MFCD13189193
Product Description
Catalog Number:
AG01BTJR
Chemical Name:
6-chloro-4-(trifluoromethyl)pyridine-2-carbaldehyde
CAS Number:
1060805-47-1
Molecular Formula:
C7H3ClF3NO
Molecular Weight:
209.5530
MDL Number:
MFCD13189193
IUPAC Name:
6-chloro-4-(trifluoromethyl)pyridine-2-carbaldehyde
InChI:
InChI=1S/C7H3ClF3NO/c8-6-2-4(7(9,10)11)1-5(3-13)12-6/h1-3H
InChI Key:
VWZOMLFQQVTPGM-UHFFFAOYSA-N
SMILES:
O=Cc1nc(Cl)cc(c1)C(F)(F)F
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.986g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.552g/mol
Monoisotopic Mass:
208.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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