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1260672-48-7 | Pyrimido[5,4-d]pyrimidine, 4-chloro-
CAS No: 1260672-48-7 Catalog No: AG000R0S MDL No:
Product Description
Catalog Number:
AG000R0S
Chemical Name:
Pyrimido[5,4-d]pyrimidine, 4-chloro-
CAS Number:
1260672-48-7
Molecular Formula:
C6H3ClN4
Molecular Weight:
166.5678
IUPAC Name:
4-chloropyrimido[5,4-d]pyrimidine
InChI:
InChI=1S/C6H3ClN4/c7-6-5-4(9-3-11-6)1-8-2-10-5/h1-3H
InChI Key:
IMADTTGGFZWIDZ-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1ncnc2
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.005g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.568g/mol
Monoisotopic Mass:
166.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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