Home Nitriles 2-Oxo-3,4-dihydro-1H-quinoline-6-carbonitrile

2-Oxo-3,4-dihydro-1H-quinoline-6-carbonitrile

CAS No.:
159053-44-8
Catalog Number:
AG001QFP
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$300
- +
1g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG001QFP
Chemical Name:
2-Oxo-3,4-dihydro-1H-quinoline-6-carbonitrile
CAS Number:
159053-44-8
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
MDL Number:
MFCD13179482
IUPAC Name:
2-oxo-3,4-dihydro-1H-quinoline-6-carbonitrile
InChI:
InChI=1S/C10H8N2O/c11-6-7-1-3-9-8(5-7)2-4-10(13)12-9/h1,3,5H,2,4H2,(H,12,13)
InChI Key:
JLJAWZROXAVJMK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)CCC(=O)N2
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.064g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.187g/mol
Monoisotopic Mass:
172.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties