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89732-11-6

89732-11-6 | 1H-Indole-3-acetonitrile, 2-methyl-7-(2-phenylethyl)-

CAS No: 89732-11-6 Catalog No: AG0041SY MDL No:

Product Description

Catalog Number:
AG0041SY
Chemical Name:
1H-Indole-3-acetonitrile, 2-methyl-7-(2-phenylethyl)-
CAS Number:
89732-11-6
Molecular Formula:
C19H18N2
Molecular Weight:
274.3596
IUPAC Name:
2-[2-methyl-7-(2-phenylethyl)-1H-indol-3-yl]acetonitrile
InChI:
InChI=1S/C19H18N2/c1-14-17(12-13-20)18-9-5-8-16(19(18)21-14)11-10-15-6-3-2-4-7-15/h2-9,21H,10-12H2,1H3
InChI Key:
GXQNMFFSEHMVCW-UHFFFAOYSA-N
SMILES:
N#CCc1c(C)[nH]c2c1cccc2CCc1ccccc1

Properties

Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.367g/mol
Monoisotopic Mass:
274.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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