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

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

CAS No.:
1094260-61-3
Catalog Number:
AG01A7UT
Molecular Formula:
C7H7ClN4
Molecular Weight:
182.6103
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Product Description
Catalog Number:
AG01A7UT
Chemical Name:
7-chloro-3-ethyl-[1,2,4]triazolo[4,3-c]pyrimidine
CAS Number:
1094260-61-3
Molecular Formula:
C7H7ClN4
Molecular Weight:
182.6103
MDL Number:
MFCD11182597
IUPAC Name:
7-chloro-3-ethyl-[1,2,4]triazolo[4,3-c]pyrimidine
InChI:
InChI=1S/C7H7ClN4/c1-2-6-10-11-7-3-5(8)9-4-12(6)7/h3-4H,2H2,1H3
InChI Key:
MPLZLQKZIHUENG-UHFFFAOYSA-N
SMILES:
CCc1nnc2n1cnc(c2)Cl
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.036g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.611g/mol
Monoisotopic Mass:
182.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties