Triethyl Citrate

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,2,3-triethyl ester
1,2,3-Propanetricarboxylic acid, 2-hydroxy-, triethyl ester
Citric acid, triethyl ester
Citroflex 2
Citroflex 2SC60
Citroflex C 2
Citroflex EC
Citroflex SC 60
Citrofol AI
Dermofeel TEC Eco
Ethyl citrate
Eudraflex
Hydragen CAT
Morflex C 2
Morflex TEC
triethyl 2-hydroxypropane-1,2,3-tricarboxylate
Uniplex 80

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	DOOTYTYQINUNNV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C12H20O7/c1-4-17-9(13)7-12(16,11(15)19-6-3)8-10(14)18-5-2/h16H,4-8H2,1-3H3
IUPAC name chemrof:IUPAC_name	Triethyl Citrate
Molecular formula chemrof:molecular_formula	C12H20O7
Molecular mass chemrof:molecular_mass	276.285
Monoisotopic mass chemrof:monoisotopic_mass	276.1209, 276.120903
SMILES string chemrof:smiles_string	CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=77-93-0	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:168426	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.157.872	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1350	enrich_references.pubchem_identifier_url
ChemSpider	https://www.chemspider.com/Chemical-Structure.13850879.html	enrich_references.chebi_xrefs
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID0040701	enrich_references.pubchem_identifier_url
drugbank.ca	https://www.drugbank.ca/drugs/DB16827	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8907	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL464988	enrich_references.pubchem_identifier_url
femaflavor.org	https://www.femaflavor.org/flavor-library/triethyl-citrate	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8Z96QXD6UM	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0034263	enrich_references.chebi_xrefs
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.215C	enrich_references.pubchem_identifier_url
KEGG	https://www.genome.jp/entry/D06228	enrich_references.chebi_xrefs
kegg.jp	https://www.kegg.jp/entry/D06228	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=46460	enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov	https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C76736	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/6506	enrich_references.pubchem_compound
rxnav.nlm.nih.gov	https://rxnav.nlm.nih.gov/id/rxnorm/1310554	enrich_references.pubchem_identifier_url
wikidata.org	https://www.wikidata.org/wiki/Q418057	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Triethyl_citrate	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
4323aec4-fbdf-4676-b3f8-bbec5b0c7406	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
cfcc7b74-160e-4cdc-bfd1-e0b436bf1ab3	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
df7da734-99cc-41c7-a570-599a074695d1	Environmental → Air → Indoor	EF 3.1	kg	4
2539a531-ddd8-4ad2-a38e-20a17805d068	Environmental → Air → Long-term	EF 3.1	kg	0
6dd9206f-1047-40e3-8f38-d418ee11b8e0	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
2302cf47-74c2-4b0e-8266-9332ece7bbd8	Environmental → Air → Unknown	EF 3.1	kg	4
af77752a-89b7-4da1-aec9-1ca25b65dd65	Environmental → Ground → Agricultural	EF 3.1	kg	4
8bb60c90-61de-474f-989e-b5a2e857100b	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
60156a7e-8a58-45d1-bb8e-2633e52f6504	Environmental → Ground → Unknown	EF 3.1	kg	4
4f110d1b-5e04-402c-84f1-99a9913374be	Environmental → Water → Long-term	EF 3.1	kg	0
13f91b91-fcec-427a-8036-0ab264a00a90	Environmental → Water → Ocean	EF 3.1	kg	4
c4ce8663-eab3-4774-baf2-c00767143c85	Environmental → Water → Surface water	EF 3.1	kg	4
d62f1168-ba9c-4558-9069-f7926475f233	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

{
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Triethyl Citrate

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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