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294662-09-2 | Imidazo[1,2-b][1,2,4]triazolo[4,3-d][1,2,4]triazine(9CI)
CAS No: 294662-09-2 Catalog No: AG002YH3 MDL No:MFCD28050470
Product Description
Catalog Number:
AG002YH3
Chemical Name:
Imidazo[1,2-b][1,2,4]triazolo[4,3-d][1,2,4]triazine(9CI)
CAS Number:
294662-09-2
Molecular Formula:
C6H4N6
Molecular Weight:
160.1362
MDL Number:
MFCD28050470
IUPAC Name:
1,3,6,7,10,11-hexazatricyclo[7.3.0.02,6]dodeca-2,4,7,9,11-pentaene
InChI:
InChI=1S/C6H4N6/c1-2-12-6(7-1)11-4-8-10-5(11)3-9-12/h1-4H
InChI Key:
IMKPETPCWDWSSP-UHFFFAOYSA-N
SMILES:
n1cn2c(n1)cnn1c2ncc1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.05g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.14g/mol
Monoisotopic Mass:
160.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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