Isooctan-1-ol

UUID 1147a983-dfb8-4901-a09a-8480e272d92b

Flow Object ID fo-3f75800a19e6d8db

Source EF 3.1

Context Environmental → Water → Ocean

CAS Numbers 1653-40-3

prefLabel

Language	Value	Provenance
`en`	`Isooctan-1-ol`

altLabel

Language	Value	Provenance
`en`	`6-methyl-1-heptanol`
`en`	`6-methylheptan-1-ol`
`en`	`6-methylheptanol`
`en`	`1-heptanol, 6-methyl-`

Definitions

Language	Value	Provenance
`en`	A primary alcohol that is heptane which is substituted by a methyl group at position 6 and a hydroxy group at position 1.

References

Shared Properties

Predicate	Value
Formal charge	`0`
InChIKey	`BWDBEAQIHAEVLV-UHFFFAOYSA-N`
InChI	`InChI=1S/C8H18O/c1-8(2)6-4-3-5-7-9/h8-9H,3-7H2,1-2H3`
IUPAC name	`6-methyl-1-heptanol, 6-methylheptan-1-ol`
Molecular formula	`C8H18O`
Molecular mass	`130.231`
Monoisotopic mass	`130.13577`
SMILES	`CC(C)CCCCCO`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`1147a983-dfb8-4901-a09a-8480e272d92b`	1-heptanol, 6-methyl-

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	1-heptanol, 6-methyl-	Emissions/Emissions to water/Emissions to sea water	kg	`exactMatch`	—

Consolidated Field Provenance

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

Field	Change Count	Latest Time	Transformers	Latest Comment
`cas_match_labels`	1	`—`	consensus_match	group_key=1-heptanol,6-methyl-\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi']; cas_sources={'1653-40-3': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-3f75800a19e6d8db: {'1653-40-3': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Ocean

Consensus Changes

Field	Old Value	New Value	Comment
`cas_match_labels`	`None`	`{'1653-40-3': 'exactMatch'}`	group_key=1-heptanol,6-methyl-\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi']; cas_sources={'1653-40-3': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-3f75800a19e6d8db: {'1653-40-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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