Home Aminos 2-[methyl(7H-purin-6-yl)amino]acetic acid

2-[methyl(7H-purin-6-yl)amino]acetic acid

CAS No.:
1000933-27-6
Catalog Number:
AG019LJ5
Molecular Formula:
C8H9N5O2
Molecular Weight:
207.1894
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Product Description
Catalog Number:
AG019LJ5
Chemical Name:
2-[methyl(7H-purin-6-yl)amino]acetic acid
CAS Number:
1000933-27-6
Molecular Formula:
C8H9N5O2
Molecular Weight:
207.1894
MDL Number:
MFCD09944032
IUPAC Name:
2-[methyl(7H-purin-6-yl)amino]acetic acid
InChI:
InChI=1S/C8H9N5O2/c1-13(2-5(14)15)8-6-7(10-3-9-6)11-4-12-8/h3-4H,2H2,1H3,(H,14,15)(H,9,10,11,12)
InChI Key:
ZSGVBHCWQGRFDO-UHFFFAOYSA-N
SMILES:
OC(=O)CN(c1ncnc2c1[nH]cn2)C
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.076g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.193g/mol
Monoisotopic Mass:
207.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties