Home Indole and Oxindoles 1000343-22-5
1000343-22-5,MFCD09026973
Catalog No.:AA0000I0
1H-Indole-5-carbonitrile, 6-methyl- | 1000343-22-5
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Purity
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Price(USD)
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1g
97%
1 week  
$320.00
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Technical Information
Catalog Number:
AA0000I0
Chemical Name:
1H-Indole-5-carbonitrile, 6-methyl-
CAS Number:
1000343-22-5
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
MDL Number:
MFCD09026973
IUPAC Name:
6-methyl-1H-indole-5-carbonitrile
InChI:
InChI=1S/C10H8N2/c1-7-4-10-8(2-3-12-10)5-9(7)6-11/h2-5,12H,1H3
InChI Key:
RKHWDANYXRMLOW-UHFFFAOYSA-N
SMILES:
N#Cc1cc2cc[nH]c2cc1C
Properties
Computed Properties
 
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.188g/mol
Monoisotopic Mass:
156.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Synonyms
 
5-Cyano-6-methyl indole 
1000343-22-5 
MFCD09026973 
ZINC14985755 
AKOS006289793 
KS-000006F7 
AJ-66419 
AK141027 
AS-34223 
BC600089 
AB0046981 
AX8281232 
6-Methyl-1H-indole-5-carbonitrile 
4CH-000040 
CS-0050503 
ST24045474 
W-1174 
ACN-027455 
3-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDRO-5-METHYL-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE 
5-Cyano-6-methylindole 
1H-Indole-5-carbonitrile, 6-methyl- 
SCHEMBL12803944 
DTXSID70646651 
RKHWDANYXRMLOW-UHFFFAOYSA-N 
CC-783 
FCH863565 
Literature
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