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782499-58-5 | 1H-Cyclopropa[3,4]cyclopent[1,2-d]imidazole(9CI)
CAS No: 782499-58-5 Catalog No: AG008N7A MDL No:
Product Description
Catalog Number:
AG008N7A
Chemical Name:
1H-Cyclopropa[3,4]cyclopent[1,2-d]imidazole(9CI)
CAS Number:
782499-58-5
Molecular Formula:
C7H4N2
Molecular Weight:
116.1201
IUPAC Name:
7,9-diazatricyclo[4.3.0.02,4]nona-1,3,5,8-tetraene
InChI:
InChI=1S/C7H4N2/c1-4-2-6-7(5(1)4)9-3-8-6/h1-3H,(H,8,9)
InChI Key:
ZNQFXBINCVPRQJ-UHFFFAOYSA-N
SMILES:
c1[nH]c2c(n1)c1c(c2)c1
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.037g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
116.123g/mol
Monoisotopic Mass:
116.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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