2',3',4'-trimethoxyacetophenone

1-(2,3,4-Trimethoxyphenyl)ethan-1-one
1-(2,3,4-Trimethoxyphenyl)ethanone
2′,3′,4′-Trimethoxyacetophenone
Acetophenone, 2′,3′,4′-trimethoxy-
Ethanone, 1-(2,3,4-trimethoxyphenyl)-
Methyl 2,3,4-trimethoxyphenyl ketone
Tri-O-methylgallacetophenone

Property	Value
InChI2D key string chemrof:inchi2d_key_string	PKNAATJMQOUREZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C11H14O4/c1-7(12)8-5-6-9(13-2)11(15-4)10(8)14-3/h5-6H,1-4H3
IUPAC name chemrof:IUPAC_name	2',3',4'-trimethoxyacetophenone
Molecular formula chemrof:molecular_formula	C11H14O4
Molecular mass chemrof:molecular_mass	210.229
Monoisotopic mass chemrof:monoisotopic_mass	210.089209
SMILES string chemrof:smiles_string	COc1ccc(C(C)=O)c(OC)c1OC

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=13909-73-4	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.034.239	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7022257	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=68811	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/F3JC7ZP11A	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J60.319H	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/83810	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27277586	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
ae58d431-aa72-4d13-a083-1d6313bd66eb	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
05bd5af6-8ad1-47d9-bd2c-7b94bc7f4924	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
9910584b-164e-468f-943d-32a55255ba7b	Environmental → Air → Indoor	EF 3.1	kg	2
3970836a-f08a-4174-926c-96eed7f6b8cd	Environmental → Air → Long-term	EF 3.1	kg	0
d2d8ba9a-355b-4f3b-8486-646572386845	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
a367cd04-e9c5-40e7-b31e-59304296bc70	Environmental → Air → Unknown	EF 3.1	kg	2
c12102b2-a350-4840-a109-40ff25b71b3f	Environmental → Ground → Agricultural	EF 3.1	kg	2
a92f5f40-58b5-4b3a-85bb-54c2aeb714bb	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
86b1f993-aef4-4c23-822d-62b0b6925740	Environmental → Ground → Unknown	EF 3.1	kg	2
435d2a88-6d9d-4e73-8342-289e53806724	Environmental → Water → Long-term	EF 3.1	kg	0
e50e4b76-510e-4fe1-9e14-99ce2c688c16	Environmental → Water → Ocean	EF 3.1	kg	2
2d9fa867-3ec3-463b-8d8f-99c68e1100e2	Environmental → Water → Surface water	EF 3.1	kg	2
dee4992c-c1b0-4d9b-a20c-5982cd6291f5	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

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2',3',4'-trimethoxyacetophenone

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