4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate

CAS Registry Number®

84078-44-4

CAS Name

4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate

Molecular Formula

C27H42O2

Molecular Mass

398.62

Cite this Page

4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=84078-44-4 (retrieved 2024-11-05) (CAS RN: 84078-44-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C27H42O2/c1-3-5-6-8-22-11-19-26(20-12-22)29-27(28)25-17-15-24(16-18-25)23-13-9-21(7-4-2)10-14-23/h11-12,19-21,23-25H,3-10,13-18H2,1-2H3/t21-,23-,24-,25-

InChIKey

InChIKey=QDZHKLQGOIWETL-QWZLJSJVNA-N

SMILES

C(OC1=CC=C(CCCCC)C=C1)(=O)[C@H]2CC[C@@](CC2)([C@]3(CC[C@H](CCC)CC3)[H])[H]

Canonical SMILES

O=C(OC1=CC=C(C=C1)CCCCC)C2CCC(CC2)C3CCC(CCC)CC3

Other Names for this Substance

  • [1,1′-Bicyclohexyl]-4-carboxylic acid, 4′-propyl-, 4-pentylphenyl ester, (trans,trans)-
  • 4-Pentylphenyl (trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-carboxylate

CAS INSIGHTSTM
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