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500338-80-7 | 1H-1,2,3-Triazolo[4,5-d]pyrimidine, 5,7-dichloro-
CAS No: 500338-80-7 Catalog No: AG01FNGV MDL No:
Product Description
Catalog Number:
AG01FNGV
Chemical Name:
1H-1,2,3-Triazolo[4,5-d]pyrimidine, 5,7-dichloro-
CAS Number:
500338-80-7
IUPAC Name:
5,7-dichloro-2H-triazolo[4,5-d]pyrimidine
InChI:
InChI=1S/C4HCl2N5/c5-2-1-3(10-11-9-1)8-4(6)7-2/h(H,7,8,9,10,11)
InChI Key:
ZHCMLGWKJKQHTQ-UHFFFAOYSA-N
NSC Number:
36911
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.961g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.987g/mol
Monoisotopic Mass:
188.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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