1,2-Propanediol, 3-[4-[1-[4-[(2S)-2-(acetyloxy)-3-chloropropoxy]phenyl]-1-methylethyl]phenoxy]-, 1,2-diacetate, (2S)-

CAS Registry Number®

1637573-04-6
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CAS Name

1,2-Propanediol, 3-[4-[1-[4-[(2S)-2-(acetyloxy)-3-chloropropoxy]phenyl]-1-methylethyl]phenoxy]-, 1,2-diacetate, (2S)-

Molecular Formula

C27H33ClO8

Molecular Mass

521.00

Cite this Page

1,2-Propanediol, 3-[4-[1-[4-[(2S)-2-(acetyloxy)-3-chloropropoxy]phenyl]-1-methylethyl]phenoxy]-, 1,2-diacetate, (2S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1637573-04-6 (retrieved 2024-04-27) (CAS RN: 1637573-04-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H33ClO8/c1-18(29)32-16-26(36-20(3)31)17-34-24-12-8-22(9-13-24)27(4,5)21-6-10-23(11-7-21)33-15-25(14-28)35-19(2)30/h6-13,25-26H,14-17H2,1-5H3/t25-,26-/m1/s1

InChIKey

InChIKey=HGHVYYKTOXUQNT-CLJLJLNGSA-N

SMILES

C(C)(C)(C1=CC=C(OC[C@H](OC(C)=O)CCl)C=C1)C2=CC=C(OC[C@@H](COC(C)=O)OC(C)=O)C=C2

Canonical SMILES

O=C(OCC(OC(=O)C)COC1=CC=C(C=C1)C(C2=CC=C(OCC(OC(=O)C)CCl)C=C2)(C)C)C

Other Names for this Substance

  • 1,2-Propanediol, 3-[4-[1-[4-[(2S)-2-(acetyloxy)-3-chloropropoxy]phenyl]-1-methylethyl]phenoxy]-, 1,2-diacetate, (2S)-
  • EPI 506

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