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150100-72-4 | 1H,6H-Pyrazolo[1',2':1,2]pyrazolo[3,4-d]pyridazine (9CI)
CAS No: 150100-72-4 Catalog No: AG001MB6 MDL No:
Product Description
Catalog Number:
AG001MB6
Chemical Name:
1H,6H-Pyrazolo[1',2':1,2]pyrazolo[3,4-d]pyridazine (9CI)
CAS Number:
150100-72-4
Molecular Formula:
C8H8N4
Molecular Weight:
160.1759
IUPAC Name:
2,6,10,11-tetrazatricyclo[6.4.0.02,6]dodeca-1(12),4,7,10-tetraene
InChI:
InChI=1S/C8H8N4/c1-2-11-6-7-4-9-10-5-8(7)12(11)3-1/h1-2,5-6H,3-4H2
InChI Key:
WRVOSZRVTGOAFW-UHFFFAOYSA-N
SMILES:
N1=NC=c2c(C1)cn1n2CC=C1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.18g/mol
Monoisotopic Mass:
160.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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