Home Aminos 2-(aminomethyl)-3,4-dihydropyrimidin-4-one dihydrochloride

2-(aminomethyl)-3,4-dihydropyrimidin-4-one dihydrochloride

CAS No.:
1955506-42-9
Catalog Number:
AG01C4S3
Molecular Formula:
C5H9Cl2N3O
Molecular Weight:
198.0505
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Product Description
Catalog Number:
AG01C4S3
Chemical Name:
2-(aminomethyl)-3,4-dihydropyrimidin-4-one dihydrochloride
CAS Number:
1955506-42-9
Molecular Formula:
C5H9Cl2N3O
Molecular Weight:
198.0505
MDL Number:
MFCD29906986
IUPAC Name:
2-(aminomethyl)-1H-pyrimidin-6-one;dihydrochloride
InChI:
InChI=1S/C5H7N3O.2ClH/c6-3-4-7-2-1-5(9)8-4;;/h1-2H,3,6H2,(H,7,8,9);2*1H
InChI Key:
DFORKZHGKMFLRX-UHFFFAOYSA-N
SMILES:
NCc1nccc(=O)[nH]1.Cl.Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.012g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
198.047g/mol
Monoisotopic Mass:
197.012g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties