Cas no 91619-39-5 (3-(azepane-1-sulfonyl)aniline)

3-(azepane-1-sulfonyl)aniline structure
3-(azepane-1-sulfonyl)aniline structure
Product Name:3-(azepane-1-sulfonyl)aniline
CAS No:91619-39-5
MF:C12H18N2O2S
MW:254.348521709442
MDL:MFCD03147234
CID:817913
PubChem ID:5004919
Update Time:2025-04-19

3-(azepane-1-sulfonyl)aniline Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 3-[(hexahydro-1H-azepin-1-yl)sulfonyl]-
    • 3-(azepan-1-ylsulfonyl)aniline
    • 3-(Azepane-1-sulfonyl)-phenylamine
    • 1-(3-amino-benzenesulfonyl)-hexahydro-azepine
    • 1-(3-Amino-benzolsulfonyl)-hexahydro-azepin
    • 3-(azepane-1-sulfonyl)aniline
    • Z56896275
    • AKOS000115409
    • EN300-02365
    • MFCD03147234
    • J-510796
    • 91619-39-5
    • TQR0238
    • SR-01000040682-1
    • DTXSID10407440
    • CHEMBL4537663
    • SR-01000040682
    • G36854
    • MDL: MFCD03147234
    • Inchi: 1S/C12H18N2O2S/c13-11-6-5-7-12(10-11)17(15,16)14-8-3-1-2-4-9-14/h5-7,10H,1-4,8-9,13H2
    • InChI Key: OXDMSVNDLGEMFK-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=C(C=1)N)(N1CCCCCC1)(=O)=O

Computed Properties

  • Exact Mass: 254.10900
  • Monoisotopic Mass: 254.10889899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 329
  • 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: 1.6
  • Topological Polar Surface Area: 71.8?2

Experimental Properties

  • PSA: 71.78000
  • LogP: 3.43340

3-(azepane-1-sulfonyl)aniline Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-(azepane-1-sulfonyl)aniline Pricemore >>

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