Home Other Building Blocks 4-(4,6-dimethoxypyrimidin-2-yl)aniline

4-(4,6-dimethoxypyrimidin-2-yl)aniline

CAS No.:
387350-86-9
Catalog Number:
AG00C8AF
Molecular Formula:
C12H13N3O2
Molecular Weight:
231.2505
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Product Description
Catalog Number:
AG00C8AF
Chemical Name:
4-(4,6-dimethoxypyrimidin-2-yl)aniline
CAS Number:
387350-86-9
Molecular Formula:
C12H13N3O2
Molecular Weight:
231.2505
MDL Number:
MFCD01319482
IUPAC Name:
4-(4,6-dimethoxypyrimidin-2-yl)aniline
InChI:
InChI=1S/C12H13N3O2/c1-16-10-7-11(17-2)15-12(14-10)8-3-5-9(13)6-4-8/h3-7H,13H2,1-2H3
InChI Key:
QMGUXTLACGZGBE-UHFFFAOYSA-N
SMILES:
COc1cc(OC)nc(n1)c1ccc(cc1)N
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.101g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.255g/mol
Monoisotopic Mass:
231.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
70.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties