Methyl 3-methylbut-2-enoate

2-Butenoic acid, 3-methyl-, methyl ester
3-Methyl-2-butenoic acid methyl ester
3-Methylcrotonic acid methyl ester
Crotonic acid, 3-methyl-, methyl ester
Methyl 3,3-dimethacrylate
Methyl 3,3-dimethylacrylate
Methyl 3-methyl-2-butenoate
Methyl 3-methylcrotonate
Methyl dimethylacrylate
Methyl senecioate
Methyl β,β-dimethylacrylate
Methyl β-methylcrotonate
Senecioic acid, methyl ester

Property	Value
InChI2D key string chemrof:inchi2d_key_string	FZIBCCGGICGWBP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H10O2/c1-5(2)4-6(7)8-3/h4H,1-3H3
IUPAC name chemrof:IUPAC_name	Methyl 3-methylbut-2-enoate
Molecular formula chemrof:molecular_formula	C6H10O2
Molecular mass chemrof:molecular_mass	114.144
Monoisotopic mass chemrof:monoisotopic_mass	114.06808
SMILES string chemrof:smiles_string	COC(=O)C=C(C)C

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=924-50-5	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.011.917	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID1061283	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL299017	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6YS6J4URT3	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J111.191D	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/13546	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q72492778	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
d052f7b9-3f1a-4b97-9499-10b99f9ebf7b	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
43a76ca2-aa45-405b-af26-b9b4ddccd23d	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
e5a8020a-8ae1-46c7-8ecc-390c3923b585	Environmental → Air → Indoor	EF 3.1	kg	2
b913394e-602d-4f31-b1bc-fab4ddea1449	Environmental → Air → Long-term	EF 3.1	kg	0
db44305c-5123-40d6-97ef-f8f4b5880bdc	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
2d83ee28-1e57-43f6-8822-f4b3980ddb35	Environmental → Air → Unknown	EF 3.1	kg	2
c8559f80-0aa1-4e27-9d36-d94d934436f1	Environmental → Ground → Agricultural	EF 3.1	kg	2
cfb6309f-fd6f-4a25-8449-c928e1b2a89b	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
ce198293-d158-425f-91a7-aa7c980f14ad	Environmental → Ground → Unknown	EF 3.1	kg	2
be0ed801-a4d8-465a-b8d8-fc1c599e67e8	Environmental → Water → Long-term	EF 3.1	kg	0
0c558c7d-4da2-40ae-8d48-1d261b60a6d6	Environmental → Water → Ocean	EF 3.1	kg	2
848b0455-6ef6-402f-87f3-4fb350ca1bed	Environmental → Water → Surface water	EF 3.1	kg	2
dfef5c9b-f3df-4f14-8b29-4354e6df3b7d	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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}

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Methyl 3-methylbut-2-enoate

Identity

Structure

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