Vitas-M small molecule compound

4-chlorophenyl 4-tert-butylbenzoate

Catalog ID
STK078958
SMILES Clc1ccc(cc1)OC(=O)c1ccc(cc1)C(C)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H17ClO2 MW 288.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClO2/c1-17(2,3)13-6-4-12(5-7-13)16(19)20-15-10-8-14(18)9-11-15/h4-11H,1-3H3
InChIKey
ZGCDPSGQTSOKPN-UHFFFAOYSA-N
Synonyms
314046-46-3
(4CHLOROPHENYL)4TERTBUTYLBENZOATE
314046463
4CHLOROPHENYL4TERTBUTYLBENZOATE
4TERTBUTYLBENZOICACID4CHLOROPHENYLESTER
CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)Cl
Clc1ccc(cc1)OC(=O)c1ccc(cc1)C(C)(C)C
InChI=1SC17H17ClO2c117(23)136412(5713)16(19)201510814(18)91115h411H13H3
MFCD00622736
STK078958
ZINC000000248028
ZINC00248028
ZINC248028

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.