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Home > Indoles and Oxindole > 639499-85-7
639499-85-7 | 1-BENZYL-2-METHYL-1H-INDOLE-3-CARBONITRILE
CAS No: 639499-85-7 Catalog No: AG01DLF5 MDL No:
Product Description
Catalog Number:
AG01DLF5
Chemical Name:
1-BENZYL-2-METHYL-1H-INDOLE-3-CARBONITRILE
CAS Number:
639499-85-7
IUPAC Name:
1-benzyl-2-methylindole-3-carbonitrile
InChI:
InChI=1S/C17H14N2/c1-13-16(11-18)15-9-5-6-10-17(15)19(13)12-14-7-3-2-4-8-14/h2-10H,12H2,1H3
InChI Key:
KYZPLWBKMAMUIV-UHFFFAOYSA-N
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.313g/mol
Monoisotopic Mass:
246.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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