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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

1H-Isoindole-1,3(2H)-dione, 2-(2-propynyloxy)-

C#CCON1C(=O)c2c(C1=O)cccc2 Request for Quotation
Chemical Name: 1H-Isoindole-1,3(2H)-dione, 2-(2-propynyloxy)-
CAS Number: 4616-63-1
Product Number: AG003SF6(AGN-PC-0JLRB7)
Synonyms:
MDL No:
Molecular Formula: C11H7NO3
Molecular Weight: 201.1782

Identification/Properties

Properties
MP:
>158°C (dec.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
201.181g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
201.043g/mol
Monoisotopic Mass:
201.043g/mol
Topological Polar Surface Area:
46.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
317
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:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-(Prop-2-yn-1-yloxy)isoindoline-1,3-dione is a versatile compound frequently utilized in chemical synthesis as a key building block for the creation of various organic molecules. Due to its unique chemical structure, this compound serves as an important intermediate in the preparation of a wide range of complex organic compounds. Its propargylic functional group enables efficient and selective transformations, making it particularly valuable in the synthesis of bioactive molecules, pharmaceuticals, and advanced materials. Additionally, the isoindoline-1,3-dione moiety imparts structural rigidity and reactivity, allowing for precise control over molecular design and stereochemistry in synthetic pathways. Its utility in the field of chemical synthesis lies in its ability to facilitate strategic bond formations and structural modifications, enabling chemists to access new compounds with tailored properties and functionalities.