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Home Nitriles 7-Bromo-1-cyclohexyl-1,2,3-benzotriazole-5-carbonitrile

7-Bromo-1-cyclohexyl-1,2,3-benzotriazole-5-carbonitrile

CAS No.:
1426958-38-4
Catalog Number:
AG009WW6
Molecular Formula:
C13H13BrN4
Molecular Weight:
305.1731
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$300
- +
10g
95%
In Stock USA
United States
$525
- +
25g
95%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG009WW6
Chemical Name:
7-Bromo-1-cyclohexyl-1,2,3-benzotriazole-5-carbonitrile
CAS Number:
1426958-38-4
Molecular Formula:
C13H13BrN4
Molecular Weight:
305.1731
MDL Number:
MFCD23699517
IUPAC Name:
7-bromo-1-cyclohexylbenzotriazole-5-carbonitrile
InChI:
InChI=1S/C13H13BrN4/c14-11-6-9(8-15)7-12-13(11)18(17-16-12)10-4-2-1-3-5-10/h6-7,10H,1-5H2
InChI Key:
CVFQDZIXKOIQNA-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)c2c(c1)nnn2C1CCCCC1
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.032g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.179g/mol
Monoisotopic Mass:
304.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties