Isoindoline-1,3-diimine


Chemical Name: Isoindoline-1,3-diimine
CAS Number: 3468-11-9
Product Number: AG00BXFJ(AGN-PC-0WADIL)
Synonyms:
MDL No:
Molecular Formula: C8H7N3
Molecular Weight: 145.16128

Identification/Properties


Computed Properties
Molecular Weight:
145.165g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
145.064g/mol
Monoisotopic Mass:
145.064g/mol
Topological Polar Surface Area:
62.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
219
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
1759
Hazard Statements:
H315-H318-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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