Home Nitriles 1,2-Dimethyl-1,3-benzodiazole-5-carbonitrile

1,2-Dimethyl-1,3-benzodiazole-5-carbonitrile

CAS No.:
80073-14-9
Catalog Number:
AG005DCF
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$216
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG005DCF
Chemical Name:
1,2-Dimethyl-1,3-benzodiazole-5-carbonitrile
CAS Number:
80073-14-9
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
MDL Number:
MFCD09027483
IUPAC Name:
1,2-dimethylbenzimidazole-5-carbonitrile
InChI:
InChI=1S/C10H9N3/c1-7-12-9-5-8(6-11)3-4-10(9)13(7)2/h3-5H,1-2H3
InChI Key:
HJYJGQHRYUADIO-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)nc(n2C)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.08g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.203g/mol
Monoisotopic Mass:
171.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties