2-hydroxy-5-(1-oxooctyl)benzoic Acid

2-Hydroxy-5-octanoylbenzoic acid
5-n-Octanoylsalicylic acid
5-Octanoylsalicylic acid
Benzoic acid, 2-hydroxy-5-(1-oxooctyl)-
Effaclark
n-Octanoyl-5-salicylic acid
β-Lipohydroxy acid

Property	Value
InChI2D key string chemrof:inchi2d_key_string	IXIGWKNBFPKCCD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C15H20O4/c1-2-3-4-5-6-7-13(16)11-8-9-14(17)12(10-11)15(18)19/h8-10,17H,2-7H2,1H3,(H,18,19)
IUPAC name chemrof:IUPAC_name	2-hydroxy-5-(1-oxooctyl)benzoic Acid
Molecular formula chemrof:molecular_formula	C15H20O4
Molecular mass chemrof:molecular_mass	264.321
Monoisotopic mass chemrof:monoisotopic_mass	264.136159
SMILES string chemrof:smiles_string	CCCCCCCC(=O)c1ccc(O)c(C(=O)O)c1

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=78418-01-6	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.101.664	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.233.084	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID801025584	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5F7PJF6AA4	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.458.858K	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/9838158	enrich_references.pubchem_compound
rxnav.nlm.nih.gov	https://rxnav.nlm.nih.gov/id/rxnorm/1492035	enrich_references.pubchem_identifier_url
wikidata.org	https://www.wikidata.org/wiki/Q209407	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
787bde59-2af3-4030-8ba4-398cba8e7e64	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
f391b602-9c9d-4842-996a-d70ba32bfb88	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
6f66f3f3-7aed-42f0-a08f-dd200dee5e36	Environmental → Air → Indoor	EF 3.1	kg	4
83c03489-3e38-45d1-abe8-91f240bba23c	Environmental → Air → Long-term	EF 3.1	kg	0
673e7d6c-5fe0-43ab-8288-ac3987ef6a71	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
183d1c6e-3998-4375-a907-bd546f312c61	Environmental → Air → Unknown	EF 3.1	kg	4
cccb4ff9-9385-40d0-b73c-025d0ba134e1	Environmental → Ground → Agricultural	EF 3.1	kg	4
0b579515-127b-453f-8a22-88050de02a38	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
05fa7b68-dd91-4ccf-b682-8f46f8cd0f37	Environmental → Ground → Unknown	EF 3.1	kg	4
82c53509-5729-4b22-8f6d-a9c41ea7e283	Environmental → Water → Long-term	EF 3.1	kg	0
ae57350e-129d-4179-9230-5f38877b2c2c	Environmental → Water → Ocean	EF 3.1	kg	4
6015d355-e157-4d00-9c6b-7df8f5aaeb6f	Environmental → Water → Surface water	EF 3.1	kg	4
95fae94b-d99e-4dc6-9a2d-e8a6346b8cb7	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-hydroxy-5-(1-oxooctyl)benzoic Acid

Identity

Structure

Alternative labels

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Known URLs

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