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Isooctan-1-ol

UUID 7d180768-b80f-4c22-9ee6-17f5ae877942
Deprecated yes
Replaced By 38845097-e02d-489f-8b6b-2d9711719750
Flow Object IDfo-3f75800a19e6d8db
Source EF 3.1
Context Environmental → Ground → Unknown
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 7d180768-b80f-4c22-9ee6-17f5ae877942 1-heptanol, 6-methyl-

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

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

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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