Home Other Building Blocks 5-Cyano-2,3-dihydro-1H-indole

5-Cyano-2,3-dihydro-1H-indole

CAS No.:
15861-23-1
Catalog Number:
AG001QCK
Molecular Formula:
C9H8N2
Molecular Weight:
144.1732
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$563
- +
10g
98%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG001QCK
Chemical Name:
5-Cyano-2,3-dihydro-1H-indole
CAS Number:
15861-23-1
Molecular Formula:
C9H8N2
Molecular Weight:
144.1732
MDL Number:
MFCD07371626
IUPAC Name:
2,3-dihydro-1H-indole-5-carbonitrile
InChI:
InChI=1S/C9H8N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-2,5,11H,3-4H2
InChI Key:
KBNWGVBBEPQFIZ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)CCN2
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.069g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
144.177g/mol
Monoisotopic Mass:
144.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Efficient singlet-state deactivation of cyano-substituted indolines in protic solvents via CN--HO hydrogen bonds. Chemphyschem : a European journal of chemical physics and physical chemistry 20071221
Properties