3-(hexyloxy)propane-1,2-diol

1,2-Propanediol, 3-(hexyloxy)-
1-Hexyloxy-2,3-propanediol
1-O-Hexylglycerol
3-(Hex-1-yloxy)-1,2-propanediol
3-(Hexyloxy)-1,2-propanediol
Glycerol 1-hexyl ether
Glycerol α-hexyl ether
n-Hexyl glyceryl ether

Property	Value
InChI2D key string chemrof:inchi2d_key_string	MQVMITUCTLYRNV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H20O3/c1-2-3-4-5-6-12-8-9(11)7-10/h9-11H,2-8H2,1H3
IUPAC name chemrof:IUPAC_name	3-(hexyloxy)propane-1,2-diol
Molecular formula chemrof:molecular_formula	C9H20O3
Molecular mass chemrof:molecular_mass	176.256
Monoisotopic mass chemrof:monoisotopic_mass	176.141244
SMILES string chemrof:smiles_string	CCCCCCOCC(O)CO

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=10305-38-1	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.128.410	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID90893620	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3485P35DA4	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J50.837C	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/11229094	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27256343	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
c0bcbe88-8ea7-4c93-82a4-e4f5c0706467	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
e1ee88c8-9d75-4895-b692-987c0869c5bc	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
0c6d6bec-cfdb-4a21-8efd-dc9087313dd0	Environmental → Air → Indoor	EF 3.1	kg	2
137c1f3d-122f-41c4-a5ba-9a96507b8742	Environmental → Air → Long-term	EF 3.1	kg	0
cd5f7de4-4dd2-486a-b750-6d1a0f9ea5c4	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
880e3888-8cf7-4a16-9d1b-fda51e189f89	Environmental → Air → Unknown	EF 3.1	kg	2
df6c24e6-62c7-4178-9eca-96ecdc112410	Environmental → Ground → Agricultural	EF 3.1	kg	2
b6116ed2-df40-409f-a917-22982af21012	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
9087050c-2640-49f5-be3f-c7b037a82b22	Environmental → Ground → Unknown	EF 3.1	kg	2
a6b6cde9-17fd-481d-9325-6a07fd283eeb	Environmental → Water → Long-term	EF 3.1	kg	0
80ff03f3-07d3-40aa-8019-1a9481059b23	Environmental → Water → Ocean	EF 3.1	kg	2
1003da63-3933-4df3-b174-555324443ebb	Environmental → Water → Surface water	EF 3.1	kg	2
efb17d90-d33e-4dec-bf97-e363430a2545	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

{
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  "altLabel": [
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      "@value": "1,2-Propanediol, 3-(hexyloxy)-",
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}

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3-(hexyloxy)propane-1,2-diol

Identity

Structure

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