4-Pentylphenyl 4-(trans-4-butylcyclohexyl)benzoate

CAS Registry Number®

90937-41-0

CAS Name

4-Pentylphenyl 4-(trans-4-butylcyclohexyl)benzoate

Molecular Formula

C28H38O2

Molecular Mass

406.60

Cite this Page

4-Pentylphenyl 4-(trans-4-butylcyclohexyl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=90937-41-0 (retrieved 2025-01-21) (CAS RN: 90937-41-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C28H38O2/c1-3-5-7-9-23-12-20-27(21-13-23)30-28(29)26-18-16-25(17-19-26)24-14-10-22(11-15-24)8-6-4-2/h12-13,16-22,24H,3-11,14-15H2,1-2H3/t22-,24-

InChIKey

InChIKey=QIEMVWGALIVVIT-HCGLCNNCNA-N

SMILES

C(OC1=CC=C(CCCCC)C=C1)(=O)C2=CC=C(C=C2)[C@H]3CC[C@H](CCCC)CC3

Canonical SMILES

O=C(OC1=CC=C(C=C1)CCCCC)C2=CC=C(C=C2)C3CCC(CCCC)CC3

Other Names for this Substance

  • Benzoic acid, 4-(trans-4-butylcyclohexyl)-, 4-pentylphenyl ester
  • Benzoic acid, 4-(4-butylcyclohexyl)-, 4-pentylphenyl ester, trans-
  • 4-Pentylphenyl 4-(trans-4-butylcyclohexyl)benzoate