Home Halogens 2-[(6-chloro-2-phenylpyrimidin-4-yl)amino]ethan-1-ol

2-[(6-chloro-2-phenylpyrimidin-4-yl)amino]ethan-1-ol

CAS No.:
1707681-73-9
Catalog Number:
AG01B8LY
Molecular Formula:
C12H12ClN3O
Molecular Weight:
249.6962
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Product Description
Catalog Number:
AG01B8LY
Chemical Name:
2-[(6-chloro-2-phenylpyrimidin-4-yl)amino]ethan-1-ol
CAS Number:
1707681-73-9
Molecular Formula:
C12H12ClN3O
Molecular Weight:
249.6962
MDL Number:
MFCD00297942
IUPAC Name:
2-[(6-chloro-2-phenylpyrimidin-4-yl)amino]ethanol
InChI:
InChI=1S/C12H12ClN3O/c13-10-8-11(14-6-7-17)16-12(15-10)9-4-2-1-3-5-9/h1-5,8,17H,6-7H2,(H,14,15,16)
InChI Key:
JSVYQZUYWRFMHV-UHFFFAOYSA-N
SMILES:
OCCNc1cc(Cl)nc(n1)c1ccccc1
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.067g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.698g/mol
Monoisotopic Mass:
249.067g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties