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88299-33-6 | 2,4(1H,3H)-Pteridinedione, 6,7-dichloro-1,3-dimethyl-
CAS No: 88299-33-6 Catalog No: AG0049NE MDL No:
Product Description
Catalog Number:
AG0049NE
Chemical Name:
2,4(1H,3H)-Pteridinedione, 6,7-dichloro-1,3-dimethyl-
CAS Number:
88299-33-6
Molecular Formula:
C8H6Cl2N4O2
Molecular Weight:
261.0648
IUPAC Name:
6,7-dichloro-1,3-dimethylpteridine-2,4-dione
InChI:
InChI=1S/C8H6Cl2N4O2/c1-13-6-3(7(15)14(2)8(13)16)11-4(9)5(10)12-6/h1-2H3
InChI Key:
HSZINFVYRJTGPZ-UHFFFAOYSA-N
SMILES:
Clc1nc2c(nc1Cl)c(=O)n(c(=O)n2C)C
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.987g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.062g/mol
Monoisotopic Mass:
259.987g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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