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130859-46-0

130859-46-0 | 9H-Purin-6-amine, 9-(methyl-d3)- (9CI)

CAS No: 130859-46-0 Catalog No: AG000V0U MDL No:

Product Description

Catalog Number:
AG000V0U
Chemical Name:
9H-Purin-6-amine, 9-(methyl-d3)- (9CI)
CAS Number:
130859-46-0
Molecular Formula:
C6H4D3N5
Molecular Weight:
152.1718
IUPAC Name:
9-(trideuteriomethyl)purin-6-amine
InChI:
InChI=1S/C6H7N5/c1-11-3-10-4-5(7)8-2-9-6(4)11/h2-3H,1H3,(H2,7,8,9)/i1D3
InChI Key:
WRXCXOUDSPTXNX-FIBGUPNXSA-N
SMILES:
Nc1ncnc2c1ncn2C([2H])([2H])[2H]

Properties

Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.089g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
3  
Molecular Weight:
152.175g/mol
Monoisotopic Mass:
152.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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