Cas no 149108-61-2 (N-(P-Toluenesulfonyl)indole-3-boronic acid)

N-(P-Toluenesulfonyl)indole-3-boronic acid structure
149108-61-2 structure
Product Name:N-(P-Toluenesulfonyl)indole-3-boronic acid
CAS No:149108-61-2
MF:C15H14BNO4S
MW:315.151962757111
MDL:MFCD03093101
CID:100310
PubChem ID:3857443
Update Time:2025-04-18

N-(P-Toluenesulfonyl)indole-3-boronic acid Chemical and Physical Properties

Names and Identifiers

    • (1-tosyl-1H-Indol-3-yl)boronic acid
    • 1-TOSYL-1H-INDOL-3-YL-3-BORONIC ACID
    • 1-Tosyl-3-indoleboronic acid
    • Boronic acid,B-[1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl]-
    • N-(P-Toluenesulfonyl)indole-3-boronic acid
    • [1-(4-methylphenyl)sulfonylindol-3-yl]boronic acid
    • AKOS BRN-0398
    • N-(TOLUENESULFONYL)INDOLE-3-BORONIC ACID
    • AKOS004116041
    • MFCD03093101
    • E84181
    • J-505160
    • 149108-61-2
    • DTXSID00397427
    • ZFA10861
    • CS-0112839
    • N-(P-TOLUENESULFONYL)INDOLE-3-BORONICACID
    • AB13214
    • XADMCCFJOAXDPE-UHFFFAOYSA-N
    • Boronic acid, B-[1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl]-
    • [1-(4-methylbenzenesulfonyl)-1H-indol-3-yl]boronic acid
    • BS-21505
    • SCHEMBL1723740
    • A884303
    • 1-(4-METHYLBENZENESULFONYL)INDOL-3-YLBORONIC ACID
    • MDL: MFCD03093101
    • Inchi: 1S/C15H14BNO4S/c1-11-6-8-12(9-7-11)22(20,21)17-10-14(16(18)19)13-4-2-3-5-15(13)17/h2-10,18-19H,1H3
    • InChI Key: XADMCCFJOAXDPE-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(C)=CC=1)(N1C=C(B(O)O)C2C=CC=CC1=2)(=O)=O

Computed Properties

  • Exact Mass: 315.07400
  • Monoisotopic Mass: 315.074
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 484
  • 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
  • Topological Polar Surface Area: 87.9A^2

Experimental Properties

  • PSA: 87.91000
  • LogP: 1.94730

N-(P-Toluenesulfonyl)indole-3-boronic acid 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%

N-(P-Toluenesulfonyl)indole-3-boronic acid Pricemore >>

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T733945-100mg
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