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1249031-56-8

1249031-56-8 | N2-(3-Methoxyphenyl)pyrimidine-2,5-diamine

CAS No: 1249031-56-8 Catalog No: AG01FB79 MDL No:

Product Description

Catalog Number:
AG01FB79
Chemical Name:
N2-(3-Methoxyphenyl)pyrimidine-2,5-diamine
CAS Number:
1249031-56-8
Molecular Formula:
C11H12N4O
Molecular Weight:
216.2392
IUPAC Name:
2-N-(3-methoxyphenyl)pyrimidine-2,5-diamine
InChI:
InChI=1S/C11H12N4O/c1-16-10-4-2-3-9(5-10)15-11-13-6-8(12)7-14-11/h2-7H,12H2,1H3,(H,13,14,15)
InChI Key:
UQSJAPSDYSOVMO-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)Nc1ncc(cn1)N

Properties

Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.101g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.244g/mol
Monoisotopic Mass:
216.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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