3-methoxybutyl Acetate

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UUID 18a7388a-53cf-47a2-8179-bcd4ea8ea5b0

Flow Object ID fo-bb2c7f6e636e13eb

Source EF 3.1

Context Environmental → Air → Ground level → Rural (<1000 people/square mile)

CAS Numbers 4435-53-4

EC Numbers 224-644-9

prefLabel

Language	Value	Provenance
`en`	`3-methoxybutyl Acetate`

altLabel ⓘ

Language	Value	Provenance
`en`	`1-Butanol, 3-methoxy-, 1-acetate`
`en`	`1-Butanol, 3-methoxy-, acetate`
`en`	`3-Methoxy-1-butanol acetate`
`en`	`3-Methoxy-1-butyl acetate`
`en`	`3-Methoxy-<em>n</em>-butyl acetate`
`en`	`Acetic acid 3-methoxybutyl ester`
`en`	`Butoxyl`
`en`	`MBA`
`en`	`NSC 15638`

References

Shared Properties

Predicate	Value
InChIKey	`QMYGFTJCQFEDST-UHFFFAOYSA-N, VIMGVKLZYIXLCK-UHFFFAOYSA-N, VSVWWEAYCLOPRJ-UHFFFAOYSA-M`
InChI	`InChI=1S/C5H12O2.C2H4O2/c1-5(7-2)3-4-6;1-2(3)4/h5-6H,3-4H2,1-2H3;1H3,(H,3,4), InChI=1S/C7H14O3/c1-6(10-2)4-3-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)/p-1, InChI=1S/C7H14O3/c1-6(9-3)4-5-10-7(2)8/h6H,4-5H2,1-3H3`
IUPAC name	`3-methoxybutyl acetate, 3-methoxybutyl ethanoate, 5-methoxyhexanoate, acetic acid 3-methoxybutyl ester, acetic acid;3-methoxy-1-butanol, acetic acid;3-methoxybutan-1-ol, ethanoic acid;3-methoxybutan-1-ol`
Molecular formula	`C7H13O3-, C7H14O3, C7H16O4`
SMILES	`CC(CCCC(=O)[O-])OC, CC(CCO)OC.CC(=O)O, CC(CCOC(=O)C)OC`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`18a7388a-53cf-47a2-8179-bcd4ea8ea5b0`	3-methoxybutyl acetate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	3-methoxybutyl acetate	Emissions/Emissions to air/Emissions to air, unspecified (long-term)	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=3-methoxybutylacetate\|\|dimension=Environmental > media=Air > strata=Unknown; cas=4435-53-4; added Common Chemistry CAS names as altLabel: 1-Butanol, 3-methoxy-, 1-acetate, 1-Butanol, 3-methoxy-, acetate, 3-Methoxy-1-butanol acetate, 3-Methoxy-1-butyl acetate, 3-Methoxy-<em>n</em>-butyl acetate, Acetic acid 3-methoxybutyl ester, Butoxyl, MBA, NSC 15638; object_uuid=fo-bb2c7f6e636e13eb
`cas_match_labels`	1	`—`	consensus_match	group_key=3-methoxybutylacetate\|\|dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'4435-53-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb2c7f6e636e13eb: {'4435-53-4': 'exactMatch'}

Context Attributes

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

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '1-Butanol, 3-methoxy-, 1-acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-Butanol, 3-methoxy-, acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Methoxy-1-butanol acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Methoxy-1-butyl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Methoxy-<em>n</em>-butyl acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid 3-methoxybutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butoxyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'MBA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 15638', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4435-53-4', 'https://commonchemistry.cas.org/detail?cas_rn=4435-53-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=3-methoxybutylacetate\|\|dimension=Environmental > media=Air > strata=Unknown; cas=4435-53-4; added Common Chemistry CAS names as altLabel: 1-Butanol, 3-methoxy-, 1-acetate, 1-Butanol, 3-methoxy-, acetate, 3-Methoxy-1-butanol acetate, 3-Methoxy-1-butyl acetate, 3-Methoxy-<em>n</em>-butyl acetate, Acetic acid 3-methoxybutyl ester, Butoxyl, MBA, NSC 15638; object_uuid=fo-bb2c7f6e636e13eb
`cas_match_labels`	`None`	`{'4435-53-4': 'exactMatch'}`	group_key=3-methoxybutylacetate\|\|dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'4435-53-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb2c7f6e636e13eb: {'4435-53-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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