Aurantiol

CAS Registry Number®

89-43-0
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CAS Name

Aurantiol

Molecular Formula

C18H27NO3

Molecular Mass

305.41

Cite this Page

Aurantiol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=89-43-0 (retrieved 2024-04-23) (CAS RN: 89-43-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H27NO3/c1-14(8-7-12-18(2,3)21)11-13-19-16-10-6-5-9-15(16)17(20)22-4/h5-6,9-10,13-14,21H,7-8,11-12H2,1-4H3

InChIKey

InChIKey=BFBPISPWJZMWJN-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(N=CCC(CCCC(C)(C)O)C)C=CC=C1

Canonical SMILES

O=C(OC)C=1C=CC=CC1N=CCC(C)CCCC(O)(C)C

Other Names for this Substance

  • Benzoic acid, 2-[(7-hydroxy-3,7-dimethyloctylidene)amino]-, methyl ester
  • Anthranilic acid, N-(7-hydroxy-3,7-dimethyloctylidene)-, methyl ester
  • Aurantiol
  • Aurantium
  • Hydroxycitronellylidene methyl anthranilate

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Deleted or Replaced CAS Registry Numbers

61792-01-6

CAS INSIGHTSTM
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