Bromopropylate

CAS Registry Number®

18181-80-1

CAS Name

Bromopropylate

Molecular Formula

C17H16Br2O3

Molecular Mass

428.12

Cite this Page

Bromopropylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=18181-80-1 (retrieved 2024-11-23) (CAS RN: 18181-80-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    77 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C17H16Br2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3

InChIKey

InChIKey=FOANIXZHAMJWOI-UHFFFAOYSA-N

SMILES

C(C(OC(C)C)=O)(O)(C1=CC=C(Br)C=C1)C2=CC=C(Br)C=C2

Canonical SMILES

O=C(OC(C)C)C(O)(C1=CC=C(Br)C=C1)C2=CC=C(Br)C=C2

Other Names for this Substance

  • Benzeneacetic acid, 4-bromo-α-(4-bromophenyl)-α-hydroxy-, 1-methylethyl ester
  • Benzilic acid, 4,4′-dibromo-, isopropyl ester
  • Geigy 19851
  • Isopropyl 4,4′-dibromobenzilate
  • GS 19851

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Deleted or Replaced CAS Registry Numbers

39394-17-7

CAS INSIGHTSTM
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