sales@angenesci.com
Login | Register
logo
Structures Search
Home Nitriles 3-(1H-Pyrazol-1-yl)benzonitrile

3-(1H-Pyrazol-1-yl)benzonitrile

CAS No.:
25699-82-5
Catalog Number:
AG00BDEC
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$47
- +
5g
95%
In Stock USA
United States
$163
- +
10g
95%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG00BDEC
Chemical Name:
3-(1H-Pyrazol-1-yl)benzonitrile
CAS Number:
25699-82-5
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
MDL Number:
MFCD07772807
IUPAC Name:
3-pyrazol-1-ylbenzonitrile
InChI:
InChI=1S/C10H7N3/c11-8-9-3-1-4-10(7-9)13-6-2-5-12-13/h1-7H
InChI Key:
KLZKYUMVLIQOFX-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)n1cccn1
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.064g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.187g/mol
Monoisotopic Mass:
169.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Bis[μ-3-(1H-pyrazol-1-yl)benzonitrile-κN:N']bis-[perchloratosilver(I)]. Acta crystallographica. Section E, Structure reports online 20081001
Properties