Home Halogens 7-chloro-2-phenyl-[1,2,4]triazolo[1,5-c]pyrimidine

7-chloro-2-phenyl-[1,2,4]triazolo[1,5-c]pyrimidine

CAS No.:
1354954-02-1
Catalog Number:
AG019SM6
Molecular Formula:
C11H7ClN4
Molecular Weight:
230.6531
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Product Description
Catalog Number:
AG019SM6
Chemical Name:
7-chloro-2-phenyl-[1,2,4]triazolo[1,5-c]pyrimidine
CAS Number:
1354954-02-1
Molecular Formula:
C11H7ClN4
Molecular Weight:
230.6531
MDL Number:
MFCD20731111
IUPAC Name:
7-chloro-2-phenyl-[1,2,4]triazolo[1,5-c]pyrimidine
InChI:
InChI=1S/C11H7ClN4/c12-9-6-10-14-11(15-16(10)7-13-9)8-4-2-1-3-5-8/h1-7H
InChI Key:
MSTGTUSZWCONIJ-UHFFFAOYSA-N
SMILES:
Clc1ncn2c(c1)nc(n2)c1ccccc1
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.036g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.655g/mol
Monoisotopic Mass:
230.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties