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Home Nitriles 7-Bromo-1-isopropylbenzotriazole-5-carbonitrile

7-Bromo-1-isopropylbenzotriazole-5-carbonitrile

CAS No.:
1437794-89-2
Catalog Number:
AG00AQHM
Molecular Formula:
C10H9BrN4
Molecular Weight:
265.1093
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00AQHM
Chemical Name:
7-Bromo-1-isopropylbenzotriazole-5-carbonitrile
CAS Number:
1437794-89-2
Molecular Formula:
C10H9BrN4
Molecular Weight:
265.1093
MDL Number:
MFCD24448836
IUPAC Name:
7-bromo-1-propan-2-ylbenzotriazole-5-carbonitrile
InChI:
InChI=1S/C10H9BrN4/c1-6(2)15-10-8(11)3-7(5-12)4-9(10)13-14-15/h3-4,6H,1-2H3
InChI Key:
GEPGOLFFQHICDX-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)c2c(c1)nnn2C(C)C
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.001g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.114g/mol
Monoisotopic Mass:
264.001g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties