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Home > Aldehydes > 893734-43-5
893734-43-5 | 5-[4-(Methylsulfonyl)phenyl]-1H-indole-3-carbaldehyde
CAS No: 893734-43-5 Catalog No: AG01EYKK MDL No:
Product Description
Catalog Number:
AG01EYKK
Chemical Name:
5-[4-(Methylsulfonyl)phenyl]-1H-indole-3-carbaldehyde
CAS Number:
893734-43-5
Molecular Formula:
C16H13NO3S
Molecular Weight:
299.3443
IUPAC Name:
5-(4-methylsulfonylphenyl)-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C16H13NO3S/c1-21(19,20)14-5-2-11(3-6-14)12-4-7-16-15(8-12)13(10-18)9-17-16/h2-10,17H,1H3
InChI Key:
HAYXGDKKULZJRW-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1cc(cc2)c1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.062g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.344g/mol
Monoisotopic Mass:
299.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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