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Home > Aldehydes > 338416-52-7
338416-52-7 | 1-Methyl-2-[3-(trifluoromethyl)phenylthio]indole-3-carboxaldehyde
CAS No: 338416-52-7 Catalog No: AG01FGDD MDL No:
Product Description
Catalog Number:
AG01FGDD
Chemical Name:
1-Methyl-2-[3-(trifluoromethyl)phenylthio]indole-3-carboxaldehyde
CAS Number:
338416-52-7
IUPAC Name:
1-methyl-2-[3-(trifluoromethyl)phenyl]sulfanylindole-3-carbaldehyde
InChI:
InChI=1S/C17H12F3NOS/c1-21-15-8-3-2-7-13(15)14(10-22)16(21)23-12-6-4-5-11(9-12)17(18,19)20/h2-10H,1H3
InChI Key:
MQLWZRFIOJNWPO-UHFFFAOYSA-N
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.059g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.344g/mol
Monoisotopic Mass:
335.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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