Isopropyl Acetate

1-Methylethyl acetate
2-Acetoxypropane
2-Propyl acetate
Acetic acid, 1-methylethyl ester
Acetic acid, isopropyl ester
Isopropyl ethanoate
propan-2-yl acetate

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	JMMWKPVZQRWMSS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3
IUPAC name chemrof:IUPAC_name	Isopropyl Acetate
Molecular formula chemrof:molecular_formula	C5H10O2
Molecular mass chemrof:molecular_mass	102.133
Monoisotopic mass chemrof:monoisotopic_mass	102.06808
SMILES string chemrof:smiles_string	CC(=O)OC(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=108-21-4	enrich_references.chebi_xrefs
cdc.gov	https://www.cdc.gov/niosh-rtecs/AI4B39D0.html	enrich_references.pubchem_identifier_url
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:230546	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.003.238	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0907	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID2025478	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=9295	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1608674	enrich_references.pubchem_identifier_url
femaflavor.org	https://www.femaflavor.org/flavor-library/isopropyl-acetate	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1Y67AFK870	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0031241	enrich_references.chebi_xrefs
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.862B	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=44774	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7915	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#1220	enrich_references.pubchem_identifier_url
wikidata.org	https://www.wikidata.org/wiki/Q419799	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Isopropyl_acetate	enrich_references.chebi_xrefs

Flow	Context	Source	Unit	CFs
f214872e-6555-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	5
4d9a8790-3ddd-11dd-97db-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	5
8b76275f-412b-4773-9d86-60666e5e31a8	Environmental → Air → Indoor	EF 3.1	kg	4
fe0acd60-3ddc-11dd-a7af-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	1
4d9a8790-3ddd-11dd-97dc-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	5
fe0acd60-3ddc-11dd-a7ae-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	5
f214872c-6555-11dd-ad8b-0800200c9a66	Environmental → Ground → Agricultural	EF 3.1	kg	4
f214872f-6555-11dd-ad8b-0800200c9a66	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
f2148731-6555-11dd-ad8b-0800200c9a66	Environmental → Ground → Unknown	EF 3.1	kg	4
f2148733-6555-11dd-ad8b-0800200c9a66	Environmental → Water → Long-term	EF 3.1	kg	0
f2148730-6555-11dd-ad8b-0800200c9a66	Environmental → Water → Ocean	EF 3.1	kg	4
f214872d-6555-11dd-ad8b-0800200c9a66	Environmental → Water → Surface water	EF 3.1	kg	4
f2148732-6555-11dd-ad8b-0800200c9a66	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

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Isopropyl Acetate

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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