Isopropyl Acetate

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UUID 4d9a8790-3ddd-11dd-97db-0050c2490048

Flow Object ID fo-eb78d403b3f88bd0

Source EF 3.1

Context Environmental → Air → Ground level → Urban (>1000 people/square mile)

CAS Numbers 108-21-4

EC Numbers 203-561-1

prefLabel

Language	Value	Provenance
`en`	`Isopropyl Acetate`

altLabel ⓘ

Language	Value	Provenance
`en`	`propan-2-yl acetate`
`en`	`1-Methylethyl acetate`
`en`	`2-Acetoxypropane`
`en`	`2-Propyl acetate`
`en`	`Acetic acid, 1-methylethyl ester`
`en`	`Acetic acid, isopropyl ester`
`en`	`Isopropyl ethanoate`
`en`	`NSC 9295`

References

Shared Properties

Predicate	Value
Formal charge	`0`
InChIKey	`JMMWKPVZQRWMSS-UHFFFAOYSA-N`
InChI	`InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3`
IUPAC name	`acetic acid isopropyl ester, acetic acid propan-2-yl ester, isopropyl acetate, propan-2-yl acetate, propan-2-yl ethanoate`
Molecular formula	`C5H10O2`
Molecular mass	`102.133`
Monoisotopic mass	`102.06808`
SMILES	`CC(=O)OC(C)C, CC(C)OC(=O)C`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`4d9a8790-3ddd-11dd-97db-0050c2490048`	isopropyl acetate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	isopropyl acetate	Emissions/Emissions to air/Emissions to urban air close to ground	kg	`exactMatch`	—

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field	Change Count	Latest Time	Transformers	Latest Comment
`altLabel`	1	`—`	consensus_match	group_key=isopropylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=108-21-4; added Common Chemistry CAS names as altLabel: 1-Methylethyl acetate, 2-Acetoxypropane, 2-Propyl acetate, Acetic acid, 1-methylethyl ester, Acetic acid, isopropyl ester, Isopropyl ethanoate, NSC 9295; object_uuid=fo-eb78d403b3f88bd0
`cas_match_labels`	1	`—`	consensus_match	group_key=isopropylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'108-21-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eb78d403b3f88bd0: {'108-21-4': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Ground level
population_density	Urban (>1000 people/square mile)

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`[{'@value': 'propan-2-yl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:propan-2-yl acetate', 'http://purl.obolibrary.org/obo/CHEBI_230546', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}]`	[{'@value': 'propan-2-yl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:propan-2-yl acetate', 'http://purl.obolibrary.org/obo/CHEBI_230546', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Methylethyl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Acetoxypropane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Propyl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid, 1-methylethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid, isopropyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isopropyl ethanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 9295', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:108-21-4', 'https://commonchemistry.cas.org/detail?cas_rn=108-21-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=isopropylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=108-21-4; added Common Chemistry CAS names as altLabel: 1-Methylethyl acetate, 2-Acetoxypropane, 2-Propyl acetate, Acetic acid, 1-methylethyl ester, Acetic acid, isopropyl ester, Isopropyl ethanoate, NSC 9295; object_uuid=fo-eb78d403b3f88bd0
`cas_match_labels`	`None`	`{'108-21-4': 'exactMatch'}`	group_key=isopropylacetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'108-21-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eb78d403b3f88bd0: {'108-21-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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