1-Propene-1,2,3-tricarboxylicacid, triethyl ester, (E)- (9CI)

Modify Date: 2025-09-15 11:55:40

1-Propene-1,2,3-tricarboxylicacid, triethyl ester, (E)- (9CI) Structure
1-Propene-1,2,3-tricarboxylicacid, triethyl ester, (E)- (9CI) structure
Common Name 1-Propene-1,2,3-tricarboxylicacid, triethyl ester, (E)- (9CI)
CAS Number 68077-28-1 Molecular Weight 258.26800
Density N/A Boiling Point N/A
Molecular Formula C12H18O6 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name trans-Aconitsaeure-triaethylester
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C12H18O6
Molecular Weight 258.26800
Exact Mass 258.11000
PSA 78.90000
LogP 0.99220
InChIKey IDDWGDKSBYYEPL-VQHVLOKHSA-N
SMILES CCOC(=O)C=C(CC(=O)OCC)C(=O)OCC

 Bioassay

View more

Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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 Synonyms

(E)-1-propene-1,2,3-tricarboxylic acid,triethyl ester
1-Propene-1,2,3-tricarboxylic acid,3-methyl ester,(Z)
trans-Aconitsaeuretriethylester
propene-1c,2,3-tricarboxylic acid triethyl ester
1-Propene-1,2,3-tricarboxylic acid,3-methyl ester,(E)
Propen-1c,2,3-tricarbonsaeure-triaethylester
ethyl aconitate
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