1,3-Dioxo-2-(tetrahydro-furan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid

Base Information

• Chemical Name: 1,3-Dioxo-2-(tetrahydro-furan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid
• CAS No.: 312498-19-4
• Molecular Formula: C14H13 N O5
• Molecular Weight: 275.26
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID90386547
• Mol file: 312498-19-4.mol

Synonyms:312498-19-4;1,3-Dioxo-2-(tetrahydro-furan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid;1,3-dioxo-2-((tetrahydrofuran-2-yl)methyl)isoindoline-5-carboxylic acid;1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxylic acid;MFCD01159106;1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxylic acid;1,3-Dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carboxylic acid;1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid;Oprea1_416935;Oprea1_573513;DTXSID90386547;BBL012174;STK295850;1,3-dioxo-2-(oxolan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid;AKOS000274346;AKOS016040414;SB64863;1,3-Dioxo-2-(tetrahydrofuran-2-yl-methyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid;VS-03219;CS-0239672;EN300-21745;A924465;J-018293;F3284-8104;Z111688558;1,3-dioxo-2-((tetrahydrofuran-2-yl)methyl)isoindoline-5-carboxylicacid;1,3-dioxo-2-(tetrahydro-furan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid, AldrichCPR;1,3-DIOXO-2-(TETRAHYDRO-FURAN-2-YLMETHYL)-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLICACID

Chemical Property of 1,3-Dioxo-2-(tetrahydro-furan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid

Chemical Property:

• Vapor Pressure: 7.62E-11mmHg at 25°C
• Boiling Point: 500.7°Cat760mmHg
• PKA: 3.34±0.20(Predicted)
• Flash Point: 256.6°C
• PSA: 83.91000
• Density: g/cm³
• LogP: 1.09770
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 275.07937252
• Heavy Atom Count: 20
• Complexity: 449

Purity/Quality:

97% ^*data from raw suppliers

1,3-Dioxo-2-(tetrahydro-furan-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

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