Home Nitriles 2-Pyrrolidinoisonicotinonitrile

2-Pyrrolidinoisonicotinonitrile

CAS No.:
127680-87-9
Catalog Number:
AG000XA4
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$44
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
100g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG000XA4
Chemical Name:
2-Pyrrolidinoisonicotinonitrile
CAS Number:
127680-87-9
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD08435908
IUPAC Name:
2-pyrrolidin-1-ylpyridine-4-carbonitrile
InChI:
InChI=1S/C10H11N3/c11-8-9-3-4-12-10(7-9)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2
InChI Key:
POKSKCURNRHWPZ-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc(c1)N1CCCC1
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties