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Home Aminos 2-(aminomethyl)pyrimidine-4,6-diol hydrochloride

2-(aminomethyl)pyrimidine-4,6-diol hydrochloride

CAS No.:
1955553-55-5
Catalog Number:
AG01B50U
Molecular Formula:
C5H8ClN3O2
Molecular Weight:
177.5889
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Product Description
Catalog Number:
AG01B50U
Chemical Name:
2-(aminomethyl)pyrimidine-4,6-diol hydrochloride
CAS Number:
1955553-55-5
Molecular Formula:
C5H8ClN3O2
Molecular Weight:
177.5889
MDL Number:
MFCD28895456
IUPAC Name:
2-(aminomethyl)-4-hydroxy-1H-pyrimidin-6-one;hydrochloride
InChI:
InChI=1S/C5H7N3O2.ClH/c6-2-3-7-4(9)1-5(10)8-3;/h1H,2,6H2,(H2,7,8,9,10);1H
InChI Key:
AIGQIAPYYRTGBF-UHFFFAOYSA-N
SMILES:
NCc1nc(O)cc(n1)O.Cl
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
177.588g/mol
Monoisotopic Mass:
177.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties