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157327-52-1 | 5H-Pyrrolo[3,4-d]pyrimidin-2-amine, 6,7-dihydro-, hydrochloride (1:2)
CAS No: 157327-52-1 Catalog No: AG001PDE MDL No:MFCD08457553
Product Description
Catalog Number:
AG001PDE
Chemical Name:
5H-Pyrrolo[3,4-d]pyrimidin-2-amine, 6,7-dihydro-, hydrochloride (1:2)
CAS Number:
157327-52-1
Molecular Formula:
C6H10Cl2N4
Molecular Weight:
209.0764
MDL Number:
MFCD08457553
IUPAC Name:
6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-amine;dihydrochloride
InChI:
InChI=1S/C6H8N4.2ClH/c7-6-9-2-4-1-8-3-5(4)10-6;;/h2,8H,1,3H2,(H2,7,9,10);2*1H
InChI Key:
IDVFIDIYCKHAEX-UHFFFAOYSA-N
SMILES:
Nc1ncc2c(n1)CNC2.Cl.Cl
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.028g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
209.074g/mol
Monoisotopic Mass:
208.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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