Home Halogens 7-chloro-5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidine

7-chloro-5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidine

CAS No.:
926245-01-4
Catalog Number:
AG019P8O
Molecular Formula:
C7H7ClN4O
Molecular Weight:
198.6097
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Product Description
Catalog Number:
AG019P8O
Chemical Name:
7-chloro-5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CAS Number:
926245-01-4
Molecular Formula:
C7H7ClN4O
Molecular Weight:
198.6097
MDL Number:
MFCD09041093
IUPAC Name:
7-chloro-5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C7H7ClN4O/c1-13-3-5-2-6(8)12-7(11-5)9-4-10-12/h2,4H,3H2,1H3
InChI Key:
NGAFBVWCOQBJAL-UHFFFAOYSA-N
SMILES:
COCc1cc(Cl)n2c(n1)ncn2
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.031g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.61g/mol
Monoisotopic Mass:
198.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties