2-[(allyloxy)methyl]-2-methylbutane-1,1-diol

1,1,1-Trimethylolpropane monoallyl ether
1,3-Propanediol, 2-[(allyloxy)methyl]-2-ethyl-
1,3-Propanediol, 2-ethyl-2-[(2-propen-1-yloxy)methyl]-
1,3-Propanediol, 2-ethyl-2-[(2-propenyloxy)methyl]-
2-Allyloxymethyl-2-ethyl-1,3-propanediol
2-Ethyl-2-[(2-propen-1-yloxy)methyl]-1,3-propanediol
2-Ethyl-2-allyloxymethyl-1,3-propanediol
Trimethylolpropane allyl ether
Trimethylolpropane monoallyl ether

Property	Value
InChI2D key string chemrof:inchi2d_key_string	LZDXRPVSAKWYDH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H18O3/c1-3-5-12-8-9(4-2,6-10)7-11/h3,10-11H,1,4-8H2,2H3
IUPAC name chemrof:IUPAC_name	1,3-Propanediol, 2-[(allyloxy)methyl]-2-ethyl-
Molecular formula chemrof:molecular_formula	C9H18O3
Molecular mass chemrof:molecular_mass	174.24
Monoisotopic mass chemrof:monoisotopic_mass	174.125594
SMILES string chemrof:smiles_string	C=CCOCC(CC)(CO)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=682-11-1	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.010.603	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID5052674	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/112W61CL04	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J25.070H	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/12683	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q27251216	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
8d93f4a5-fb46-4994-a88a-114f308549b5	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
f8eb3497-0ce9-4842-832a-d3b8b15b5383	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
80609bf5-f31a-4146-987a-004e5875e6b2	Environmental → Air → Indoor	EF 3.1	kg	4
d2cbc8b9-838f-41a3-a906-350c40bf2a88	Environmental → Air → Long-term	EF 3.1	kg	0
d8c3165e-bbbc-4fcb-a179-afc2b2b91591	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
eb157a4e-b050-4de9-951a-33c40703b732	Environmental → Air → Unknown	EF 3.1	kg	4
ffbeaaa6-c9f1-4977-8f08-503c9641d6e5	Environmental → Ground → Agricultural	EF 3.1	kg	4
e1a4b935-8cf8-4302-802b-b96b5649a30a	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
049a317a-1a5a-407d-afc3-837ee4a11a16	Environmental → Ground → Unknown	EF 3.1	kg	4
acbe9b66-b74b-476f-a371-274f974d5709	Environmental → Water → Long-term	EF 3.1	kg	0
0e2057ed-774a-4b3a-8439-4bae980b580e	Environmental → Water → Ocean	EF 3.1	kg	4
315d7777-227f-45ff-af2e-8f7dc59d25a2	Environmental → Water → Surface water	EF 3.1	kg	4
9ddba19f-720f-42ad-811d-1fe79664b520	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (53 changes)

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Flow object JSON

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2-[(allyloxy)methyl]-2-methylbutane-1,1-diol

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Structure

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