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20815-46-7 | 1,2-Propadiene-1,3-diimine (9CI)
CAS No: 20815-46-7 Catalog No: AG002JJ1 MDL No:
Product Description
Catalog Number:
AG002JJ1
Chemical Name:
1,2-Propadiene-1,3-diimine (9CI)
CAS Number:
20815-46-7
Molecular Formula:
C3H2N2
Molecular Weight:
66.0614
IUPAC Name:
propa-1,2-diene-1,3-diimine
InChI:
InChI=1S/C3H2N2/c4-2-1-3-5/h4-5H
InChI Key:
WTJRKYUPEQNLPJ-UHFFFAOYSA-N
SMILES:
N=C=C=C=N
Properties
Complexity:
91.3
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
66.022g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
66.063g/mol
Monoisotopic Mass:
66.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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