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57500-34-2

57500-34-2 | Isoindoline-1,3-diimine

CAS No: 57500-34-2 Catalog No: AG003R3W MDL No:MFCD00010062

Product Description

Catalog Number:
AG003R3W
Chemical Name:
Isoindoline-1,3-diimine
CAS Number:
57500-34-2
Molecular Formula:
C8H7N3
Molecular Weight:
145.1613
MDL Number:
MFCD00010062
IUPAC Name:
3-iminoisoindol-1-amine
InChI:
InChI=1S/C8H7N3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4H,(H3,9,10,11)
InChI Key:
RZVCEPSDYHAHLX-UHFFFAOYSA-N
SMILES:
N=C1NC(=N)c2c1cccc2
EC Number:
222-426-8
NSC Number:
516222

Properties

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

Literature

Title Journal
Pt(II)-mediated imine-nitrile coupling leading to symmetrical (1,3,5,7,9-pentaazanona-1,3,6,8-tetraenato)Pt(II) complexes containing the incorporated 1,3-diiminoisoindoline moiety. Inorganic chemistry 20121015
Gold(II) phthalocyanine revisited: synthesis and spectroscopic properties of gold(III) phthalocyanine and an unprecedented ring-contracted phthalocyanine analogue. Chemistry (Weinheim an der Bergstrasse, Germany) 20120924
Facile synthesis of pegylated zinc(II) phthalocyanines via transesterification and their in vitro photodynamic activities. Organic & biomolecular chemistry 20111021
Substituted 1,3-bis(imino)isoindole diols: a new class of proton transfer dyes. Organic letters 20110401
Scrutinizing the chemical nature and photophysics of an expanded hemiporphyrazine: the special case of [30]trithia-2,3,5,10,12,13,15,20,22,23,25,30-dodecaazahexaphyrin. Journal of the American Chemical Society 20100922
Phosphorescent platinum(II) and palladium(II) complexes with azatetrabenzoporphyrins-new red laser diode-compatible indicators for optical oxygen sensing. ACS applied materials & interfaces 20100224
Palladium(II) complexes of unsymmetrical CNN pincer ligands. Inorganic chemistry 20080721
Synthesis and Biological Analysis of Thiotetra(ethylene glycol) monomethyl Ether-Functionalized Porphyrazines: Cellular Uptake and Toxicity Studies. Metal-based drugs 20080101
Diiminoisoindoline: tautomerism, conformations, and polymorphism. Chemical communications (Cambridge, England) 20040407
Synthesis and characterization of phthalocyanines with direct Si-Si linkages. Chemistry (Weinheim an der Bergstrasse, Germany) 20020315
Thiadiazole-derived expanded heteroazaporphyrinoids. Organic letters 20010712

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