Chemical Properties of 1H-Indol-3-ol, 1-acetyl-5-bromo-, acetate (CAS 33588-54-4)

InChI

InChI=1S/C12H10BrNO3/c1-7(15)14-6-12(17-8(2)16)10-5-9(13)3-4-11(10)14/h3-6H,1-2H3

InChI Key

XJRIDJAGAYGJCK-UHFFFAOYSA-N

Formula

C12H10BrNO3

SMILES

CC(=O)Oc1cn(C(C)=O)c2ccc(Br)cc12

Molecular Weight¹

296.12

CAS

33588-54-4

Other Names

• 5-Bromoindoxyl diacetate
• 5-Bromoindoxyl acetate
• 1-Acetyl-5-bromo-1H-indol-3-yl acetate
• N-acetyl-5-bromoindolyl acetate

• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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Similar Compounds

Find more compounds similar to 1H-Indol-3-ol, 1-acetyl-5-bromo-, acetate.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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