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130129-59-8 | 4-Pyrimidinamine, 5-chloro-6-ethyl-
CAS No: 130129-59-8 Catalog No: AG000U1V MDL No:
Product Description
Catalog Number:
AG000U1V
Chemical Name:
4-Pyrimidinamine, 5-chloro-6-ethyl-
CAS Number:
130129-59-8
Molecular Formula:
C6H8ClN3
Molecular Weight:
157.6008
IUPAC Name:
5-chloro-6-ethylpyrimidin-4-amine
InChI:
InChI=1S/C6H8ClN3/c1-2-4-5(7)6(8)10-3-9-4/h3H,2H2,1H3,(H2,8,9,10)
InChI Key:
OWYYGBFPJMRGCG-UHFFFAOYSA-N
SMILES:
CCc1ncnc(c1Cl)N
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.041g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.601g/mol
Monoisotopic Mass:
157.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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