Home Nitriles 1-Benzyl-1,2,3-benzotriazole-5-carbonitrile

1-Benzyl-1,2,3-benzotriazole-5-carbonitrile

CAS No.:
1242069-41-5
Catalog Number:
AG009WZ1
Molecular Formula:
C14H10N4
Molecular Weight:
234.2560
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG009WZ1
Chemical Name:
1-Benzyl-1,2,3-benzotriazole-5-carbonitrile
CAS Number:
1242069-41-5
Molecular Formula:
C14H10N4
Molecular Weight:
234.2560
MDL Number:
MFCD22549343
IUPAC Name:
1-benzylbenzotriazole-5-carbonitrile
InChI:
InChI=1S/C14H10N4/c15-9-12-6-7-14-13(8-12)16-17-18(14)10-11-4-2-1-3-5-11/h1-8H,10H2
InChI Key:
XDIDBHQGBSNAPW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)nnn2Cc1ccccc1
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.091g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.262g/mol
Monoisotopic Mass:
234.091g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties