Cas no 31500-38-6 (2-ethyl-3a,4,7,7a-tetrahydro-4,7-Methano-1H-isoindole-1,3(2H)-dione)

2-ethyl-3a,4,7,7a-tetrahydro-4,7-Methano-1H-isoindole-1,3(2H)-dione structure
31500-38-6 structure
Product Name:2-ethyl-3a,4,7,7a-tetrahydro-4,7-Methano-1H-isoindole-1,3(2H)-dione
CAS No:31500-38-6
MF:C11H13NO2
MW:191.226423025131
CID:307080
PubChem ID:98022
Update Time:2025-04-19

2-ethyl-3a,4,7,7a-tetrahydro-4,7-Methano-1H-isoindole-1,3(2H)-dione Chemical and Physical Properties

Names and Identifiers

    • 2-ethyl-3a,4,7,7a-tetrahydro-4,7-Methano-1H-isoindole-1,3(2H)-dione
    • 4,7-Methano-1H-isoindole-1,3(2H)-dione,2-ethyl-3a,4,7,7a-tetrahydro-
    • NSC 68810
    • cis-3,6-Endomethylene-1,2,3,6-tetrahydrophthalic acid N-ethylimide
    • cis-endo-N-Ethyl-5-norbornene-2,3-dicarboximide
    • NSC-68810
    • SCHEMBL522134
    • 31500-38-6
    • 2-ethyl-3a,4,7,7a-tetrahydro-1h-4,7-methanoisoindole-1,3(2h)-dione
    • 5-Norbornene-2,3-dicarboximide, N-ethyl-, (Z)-endo-
    • AKOS027475509
    • NSC68810
    • 4-ethyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
    • DTXSID90953490
    • Inchi: 1S/C11H13NO2/c1-2-12-10(13)8-6-3-4-7(5-6)9(8)11(12)14/h3-4,6-9H,2,5H2,1H3
    • InChI Key: HDNAENGLYCLHFK-UHFFFAOYSA-N
    • SMILES: O=C1C2C3C=CC(C3)C2C(N1CC)=O

Computed Properties

  • Exact Mass: 191.09500
  • Monoisotopic Mass: 191.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 317
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.6
  • Topological Polar Surface Area: 37.4?2

Experimental Properties

  • PSA: 37.38000
  • LogP: 0.75130
Recommended suppliers
Zhangzhou Sinobioway Peptide Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zhangzhou Sinobioway Peptide Co.,Ltd.
Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Suzhou Senfeida Chemical Co., Ltd
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd