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Home Halogens 3-Benzyl-7-chloro-3h-[1,2,3]-triazolo[4,5-d]pyrimidine

3-Benzyl-7-chloro-3h-[1,2,3]-triazolo[4,5-d]pyrimidine

CAS No.:
21410-06-0
Catalog Number:
AG007QL7
Molecular Formula:
C11H8ClN5
Molecular Weight:
245.6677
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$302
- +
5g
95%
1 week
United States
$830
- +
Product Description
Catalog Number:
AG007QL7
Chemical Name:
3-Benzyl-7-chloro-3h-[1,2,3]-triazolo[4,5-d]pyrimidine
CAS Number:
21410-06-0
Molecular Formula:
C11H8ClN5
Molecular Weight:
245.6677
MDL Number:
MFCD09038669
IUPAC Name:
3-benzyl-7-chlorotriazolo[4,5-d]pyrimidine
InChI:
InChI=1S/C11H8ClN5/c12-10-9-11(14-7-13-10)17(16-15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2
InChI Key:
KVYUVZPCMWVWAU-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1nnn2Cc1ccccc1
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.047g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.67g/mol
Monoisotopic Mass:
245.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties