1'-hydroxysafrole

1,3-Benzodioxole-5-methanol, α-ethenyl-
1-(1,3-Benzodioxol-5-yl)-2-propen-1-ol
1-(2H-1,3-Benzodioxol-5-yl)prop-2-en-1-ol
1-(3,4-Methylenedioxyphenyl)-2-propen-1-ol
1-(Benzo[d][1,3]dioxol-5-yl)prop-2-en-1-ol
1′-Hydroxyisosafrole
1′-Hydroxysafrole
2-(3,4-Methylenedioxyphenyl)allyl alcohol
Piperonyl alcohol, α-vinyl-
α-Ethenyl-1,3-benzodioxole-5-methanol
α-Vinyl-1,3-benzodioxole-5-methanol

Property	Value
InChI2D key string chemrof:inchi2d_key_string	VVBJNJFYBCLUAH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C10H10O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h2-5,8,11H,1,6H2
IUPAC name chemrof:IUPAC_name	1'-hydroxysafrole
Molecular formula chemrof:molecular_formula	C10H10O3
Molecular mass chemrof:molecular_mass	178.187
Monoisotopic mass chemrof:monoisotopic_mass	178.062994
SMILES string chemrof:smiles_string	C=CC(O)c1ccc2c(c1)OCO2

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=5208-87-7	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID0020731	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/C9B19855E2	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.229B	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/21268	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q27275352	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
1f3199b2-6556-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
4d9a8790-3ddd-11dd-928e-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
bcb5dca3-7fb7-44fa-941c-ea9440a1538b	Environmental → Air → Indoor	EF 3.1	kg	2
4d9a8790-3ddd-11dd-928d-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	0
4d9a8790-3ddd-11dd-928f-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
4d9a8790-3ddd-11dd-928c-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	2
4d9a8790-3ddd-11dd-928a-0050c2490048	Environmental → Ground → Agricultural	EF 3.1	kg	2
4d9a8790-3ddd-11dd-929e-0050c2490048	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
4d9a8790-3ddd-11dd-928b-0050c2490048	Environmental → Ground → Unknown	EF 3.1	kg	2
4d9a8790-3ddd-11dd-929c-0050c2490048	Environmental → Water → Long-term	EF 3.1	kg	0
4d9a8790-3ddd-11dd-929f-0050c2490048	Environmental → Water → Ocean	EF 3.1	kg	2
4d9a8790-3ddd-11dd-929b-0050c2490048	Environmental → Water → Surface water	EF 3.1	kg	2
4d9a8790-3ddd-11dd-929d-0050c2490048	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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1'-hydroxysafrole

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Structure

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