Vitas-M small molecule compound

4-cyanophenyl 4-heptylbenzoate

Catalog ID
STK031994
SMILES CCCCCCCc1ccc(cc1)C(=O)Oc1ccc(cc1)C#N

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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 C21H23NO2 MW 321.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO2/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)21(23)24-20-14-10-18(16-22)11-15-20/h8-15H,2-7H2,1H3
InChIKey
ZWAUTNYPKHVAEZ-UHFFFAOYSA-N
Synonyms
38690-76-5
(4CYANOPHENYL)4HEPTYLBENZOATE
38690765
4CYANOPHENYL4HEPTYLBENZOATE
4HEPTYLBENZOICACID(4CYANOPHENYL)ESTER
4HEPTYLBENZOICACID4CYANOPHENYL
4HEPTYLBENZOICACID4CYANOPHENYLESTER
4NHEPTYLBENZOICACID4CYANOPHENYLESTER
BENZOICACID4HEPTYL4CYANOPHENYLESTER
CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N
CCCCCCCc1ccc(cc1)C(=O)Oc1ccc(cc1)C#N
InChI=1SC21H23NO2c12345671781219(13917)21(23)2420141018(1622)111520h815H27H21H3
MFCD00001817
PCYANOPHENYLPHEPTYLBENZOATE
STK031994
ZINC000002140880
ZINC2140880

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Available files

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