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22919-46-6 | 2(1H)-Pyrimidinone, 4-amino-1-propyl-
CAS No: 22919-46-6 Catalog No: AG002LIT MDL No:
Product Description
Catalog Number:
AG002LIT
Chemical Name:
2(1H)-Pyrimidinone, 4-amino-1-propyl-
CAS Number:
22919-46-6
Molecular Formula:
C7H11N3O
Molecular Weight:
153.1817
IUPAC Name:
4-amino-1-propylpyrimidin-2-one
InChI:
InChI=1S/C7H11N3O/c1-2-4-10-5-3-6(8)9-7(10)11/h3,5H,2,4H2,1H3,(H2,8,9,11)
InChI Key:
VJRRVOYOJYNVAK-UHFFFAOYSA-N
SMILES:
CCCn1ccc(nc1=O)N
NSC Number:
211606
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.185g/mol
Monoisotopic Mass:
153.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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