4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate

CAS Registry Number®

94442-17-8

CAS Name

4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate

Molecular Formula

C21H26O2

Molecular Mass

310.43

Cite this Page

4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94442-17-8 (retrieved 2024-11-22) (CAS RN: 94442-17-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H26O2/c1-4-6-17-7-11-19(12-8-17)21(22)23-20-13-9-18(10-14-20)15-16(3)5-2/h7-14,16H,4-6,15H2,1-3H3/t16-/m0/s1

InChIKey

InChIKey=ZBKMFXVASLCFKC-INIZCTEOSA-N

SMILES

O(C(=O)C1=CC=C(CCC)C=C1)C2=CC=C(C[C@H](CC)C)C=C2

Canonical SMILES

O=C(OC1=CC=C(C=C1)CC(C)CC)C2=CC=C(C=C2)CCC

Other Names for this Substance

  • Benzoic acid, 4-propyl-, 4-[(2S)-2-methylbutyl]phenyl ester
  • Benzoic acid, 4-propyl-, 4-(2-methylbutyl)phenyl ester, (S)-
  • 4-[(2S)-2-Methylbutyl]phenyl 4-propylbenzoate

CAS INSIGHTSTM
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