Home Halogens 7-chloro-3-propyl-[1,2,4]triazolo[4,3-c]pyrimidine

7-chloro-3-propyl-[1,2,4]triazolo[4,3-c]pyrimidine

CAS No.:
1152578-03-4
Catalog Number:
AG01A6T5
Molecular Formula:
C8H9ClN4
Molecular Weight:
196.6369
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Product Description
Catalog Number:
AG01A6T5
Chemical Name:
7-chloro-3-propyl-[1,2,4]triazolo[4,3-c]pyrimidine
CAS Number:
1152578-03-4
Molecular Formula:
C8H9ClN4
Molecular Weight:
196.6369
MDL Number:
MFCD11103607
IUPAC Name:
7-chloro-3-propyl-[1,2,4]triazolo[4,3-c]pyrimidine
InChI:
InChI=1S/C8H9ClN4/c1-2-3-7-11-12-8-4-6(9)10-5-13(7)8/h4-5H,2-3H2,1H3
InChI Key:
UWLXRHGCZKWWHA-UHFFFAOYSA-N
SMILES:
CCCc1nnc2n1cnc(c2)Cl
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.052g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.638g/mol
Monoisotopic Mass:
196.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties