Cas no 110592-38-6 (1-Propanesulfonic acid, 3-[(3,5-dimethoxyphenyl)amino]-)

1-Propanesulfonic acid, 3-[(3,5-dimethoxyphenyl)amino]- structure
110592-38-6 structure
Product Name:1-Propanesulfonic acid, 3-[(3,5-dimethoxyphenyl)amino]-
CAS No:110592-38-6
MF:C11H17NO5S
MW:275.321382284164
CID:1193696
PubChem ID:9878678
Update Time:2025-04-20

1-Propanesulfonic acid, 3-[(3,5-dimethoxyphenyl)amino]- Chemical and Physical Properties

Names and Identifiers

    • 1-Propanesulfonic acid, 3-[(3,5-dimethoxyphenyl)amino]-
    • 3-(3,5-dimethoxyanilino)propane-1-sulfonic acid
    • DTXSID60432242
    • SCHEMBL244918
    • 110592-38-6
    • Inchi: 1S/C11H17NO5S/c1-16-10-6-9(7-11(8-10)17-2)12-4-3-5-18(13,14)15/h6-8,12H,3-5H2,1-2H3,(H,13,14,15)
    • InChI Key: MENXRDLDYNLDHE-UHFFFAOYSA-N
    • SMILES: S(CCCNC1C=C(C=C(C=1)OC)OC)(=O)(=O)O

Computed Properties

  • Exact Mass: 275.08281
  • Monoisotopic Mass: 275.08274382g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 7
  • Complexity: 315
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 93.2?2

Experimental Properties

  • PSA: 84.86
Recommended suppliers
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Shanghai Aoguang Biotechnology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Aoguang Biotechnology Co., Ltd
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD