Cas no 208450-86-6 (Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester)

Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester structure
208450-86-6 structure
Product Name:Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester
CAS No:208450-86-6
MF:C18H19NO4
MW:313.347765207291
CID:1400448
Update Time:2024-08-16

Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester
    • Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester (9CI)
    • Inchi: 1S/C18H19NO4/c1-22-17(20)15-7-3-5-13(9-15)11-19-12-14-6-4-8-16(10-14)18(21)23-2/h3-10,19H,11-12H2,1-2H3
    • InChI Key: AJCJICBMODGBDC-UHFFFAOYSA-N
    • SMILES: N(CC1C=CC=C(C=1)C(OC)=O)CC1C=CC=C(C=1)C(OC)=O

Computed Properties

  • Exact Mass: 313.13147

Experimental Properties

  • Density: 1.171±0.06 g/cm3(Predicted)
  • Boiling Point: 455.6±40.0 °C(Predicted)
  • PSA: 64.63
  • pka: 7.60±0.20(Predicted)

Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol ;  16 h, rt
Reference
Synthesis of N-benzyl- and N-phenyl-2-amino-4,5-dihydrothiazoles and thioureas and evaluation as modulators of the isoforms of nitric oxide synthase
Goodyer, Claire L. M.; Chinje, Edwin C.; Jaffar, Mohammed; Stratford, Ian J.; Threadgill, Michael D., Bioorganic & Medicinal Chemistry, 2003, 11(19), 4189-4206

Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester Raw materials

Benzoic acid, 3,3'-[iminobis(methylene)]bis-, dimethyl ester Preparation Products

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