Capobenic acid

CAS Registry Number®

21434-91-3

CAS Name

Capobenic acid

Molecular Formula

C16H23NO6

Molecular Mass

325.36

Cite this Page

Capobenic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21434-91-3 (retrieved 2024-11-22) (CAS RN: 21434-91-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    122 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C16H23NO6/c1-21-12-9-11(10-13(22-2)15(12)23-3)16(20)17-8-6-4-5-7-14(18)19/h9-10H,4-8H2,1-3H3,(H,17,20)(H,18,19)

InChIKey

InChIKey=MPTXLVRHYGBOQY-UHFFFAOYSA-N

SMILES

O(C)C1=C(OC)C=C(C(NCCCCCC(O)=O)=O)C=C1OC

Canonical SMILES

O=C(O)CCCCCNC(=O)C1=CC(OC)=C(OC)C(OC)=C1

Other Names for this Substance

  • Hexanoic acid, 6-[(3,4,5-trimethoxybenzoyl)amino]-
  • Hexanoic acid, 6-(3,4,5-trimethoxybenzamido)-
  • 6-[(3,4,5-Trimethoxybenzoyl)amino]hexanoic acid
  • N-(3,4,5-Trimethoxybenzoyl)-ε-aminocaproic acid
  • 3,4,5-Trimethoxybenzoyl-ε-aminocaproic acid

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration