(2,6-xylyloxy) Acetic Acid

(2,6-Dimethylphenoxy)acetic acid
2-(2,6-Dimethylphenoxy)acetic acid
Acetic acid, (2,6-dimethylphenoxy)-
Acetic acid, (2,6-xylyloxy)-
Acetic acid, 2-(2,6-dimethylphenoxy)-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	MLBCURLNKYKBEQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C10H12O3/c1-7-4-3-5-8(2)10(7)13-6-9(11)12/h3-5H,6H2,1-2H3,(H,11,12)
IUPAC name chemrof:IUPAC_name	(2,6-xylyloxy) Acetic Acid
Molecular formula chemrof:molecular_formula	C10H12O3
Molecular mass chemrof:molecular_mass	180.203
Monoisotopic mass chemrof:monoisotopic_mass	180.078644
SMILES string chemrof:smiles_string	Cc1cccc(C)c1OCC(=O)O

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=13335-71-2	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.102.922	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.106.896	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID50158085	enrich_references.pubchem_identifier_url
drugbank.ca	https://www.drugbank.ca/drugs/DB07634	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=408599	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8RVEL9W5CF	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J779.929B	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=150802	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/101369	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q27096855	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
88e5acfb-2172-44e6-8dc6-660d3fee3e36	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
aa6b04d2-b5ea-4037-8fa9-19a243938747	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
63cc7667-d82c-4b78-b0ed-79520c788dc6	Environmental → Air → Indoor	EF 3.1	kg	4
954c75ae-4a87-4c41-9a3f-ac3a5f49686f	Environmental → Air → Long-term	EF 3.1	kg	0
86376b22-5233-4f14-8d5b-73316794578d	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
bd3cdbd9-c3a0-4675-a8fd-11a4caf21013	Environmental → Air → Unknown	EF 3.1	kg	4
849055bc-341e-4aa0-8ce0-c63626b97d61	Environmental → Ground → Agricultural	EF 3.1	kg	4
34fa1dfc-a481-4338-adef-dceed569ec1e	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
eae921e9-3896-4672-9a1d-7bc786c81e73	Environmental → Ground → Unknown	EF 3.1	kg	4
8543be5b-62f0-443a-a073-bf642f38ef58	Environmental → Water → Long-term	EF 3.1	kg	0
6035f326-e402-4c39-b6f9-89c0833295f2	Environmental → Water → Ocean	EF 3.1	kg	4
7203dc05-15ad-4ba0-bedd-77b6d5b8ffd1	Environmental → Water → Surface water	EF 3.1	kg	4
f1f634d3-3ef0-4881-a1e9-bf4219b0abde	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

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(2,6-xylyloxy) Acetic Acid

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