Cas no 37088-12-3 (Benzoic acid, 2-chloro-5-[(3,5-diethyl-1-piperidinyl)sulfonyl]-)

Benzoic acid, 2-chloro-5-[(3,5-diethyl-1-piperidinyl)sulfonyl]- structure
37088-12-3 structure
Product Name:Benzoic acid, 2-chloro-5-[(3,5-diethyl-1-piperidinyl)sulfonyl]-
CAS No:37088-12-3
MF:C16H22ClNO4S
MW:359.868182659149
CID:1481088
Update Time:2024-08-23

Benzoic acid, 2-chloro-5-[(3,5-diethyl-1-piperidinyl)sulfonyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 2-chloro-5-[(3,5-diethyl-1-piperidinyl)sulfonyl]-
    • Inchi: 1S/C16H22ClNO4S/c1-3-11-7-12(4-2)10-18(9-11)23(21,22)13-5-6-15(17)14(8-13)16(19)20/h5-6,8,11-12H,3-4,7,9-10H2,1-2H3,(H,19,20)
    • InChI Key: MLZQVKGSZPXUSQ-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C1=CC(S(N2CC(CC)CC(CC)C2)(=O)=O)=CC=C1Cl

Computed Properties

  • Exact Mass: 359.09596

Experimental Properties

  • Density: 1.265±0.06 g/cm3(Predicted)
  • Boiling Point: 508.0±60.0 °C(Predicted)
  • PSA: 74.68
  • pka: 2.52±0.25(Predicted)
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