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7629-18-7 | 6-amino-1-(4-chlorophenyl)-3-methylpyrimidine-2,4(1h,3h)-dione
CAS No: 7629-18-7 Catalog No: AG005E7P MDL No:
Product Description
Catalog Number:
AG005E7P
Chemical Name:
6-amino-1-(4-chlorophenyl)-3-methylpyrimidine-2,4(1h,3h)-dione
CAS Number:
7629-18-7
Molecular Formula:
C11H10ClN3O2
Molecular Weight:
251.6690
IUPAC Name:
6-amino-1-(4-chlorophenyl)-3-methylpyrimidine-2,4-dione
InChI:
InChI=1S/C11H10ClN3O2/c1-14-10(16)6-9(13)15(11(14)17)8-4-2-7(12)3-5-8/h2-6H,13H2,1H3
InChI Key:
ZHOGFUXGYTYROH-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)n1c(N)cc(=O)n(c1=O)C
NSC Number:
71745
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.046g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.67g/mol
Monoisotopic Mass:
251.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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