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Home > Other Building Blocks > 130986-21-9
130986-21-9 | 1,4-Diazacyclopropa[cd]pentalene (9CI)
CAS No: 130986-21-9 Catalog No: AG000V7J MDL No:
Product Description
Catalog Number:
AG000V7J
Chemical Name:
1,4-Diazacyclopropa[cd]pentalene (9CI)
CAS Number:
130986-21-9
Molecular Formula:
C6H2N2
Molecular Weight:
102.0935
IUPAC Name:
4,6-diazatricyclo[3.3.0.02,8]octa-1(8),2,4,6-tetraene
InChI:
InChI=1S/C6H2N2/c1-3-4-2-8-6(7-1)5(3)4/h1-2H
InChI Key:
NATYUBKZENFCIO-UHFFFAOYSA-N
SMILES:
N1=Cc2c3c1ncc23
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
102.022g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
102.096g/mol
Monoisotopic Mass:
102.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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