Home Nitriles 1-Acetyl-1h-indole-6-carbonitrile

1-Acetyl-1h-indole-6-carbonitrile

CAS No.:
1017791-09-1
Catalog Number:
AG008VEX
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG008VEX
Chemical Name:
1-Acetyl-1h-indole-6-carbonitrile
CAS Number:
1017791-09-1
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
MDL Number:
MFCD09972002
IUPAC Name:
1-acetylindole-6-carbonitrile
InChI:
InChI=1S/C11H8N2O/c1-8(14)13-5-4-10-3-2-9(7-12)6-11(10)13/h2-6H,1H3
InChI Key:
NBLADPUTDHKBTD-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)n(cc2)C(=O)C
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.064g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties