CHEBI:88370 - hexan-2-ol

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ChEBI Name hexan-2-ol
ChEBI ID CHEBI:88370
Definition A hexanol in which the hydroxy group is at position 2.
Stars This entity has been manually annotated by a third party.
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Formula C6H14O
Net Charge 0
Average Mass 102.177
Monoisotopic Mass 102.10447
InChI InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3
InChIKey QNVRIHYSUZMSGM-UHFFFAOYSA-N
SMILES CCCCC(C)O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed
ChEBI Ontology
Outgoing hexan-2-ol (CHEBI:88370) is a hexanol (CHEBI:143552)
hexan-2-ol (CHEBI:88370) is a secondary alcohol (CHEBI:35681)
IUPAC Name
hexan-2-ol
Synonyms Sources
2-hexanol ChemIDplus
2-hexyl alcohol NIST Chemistry WebBook
2-hydroxyhexane ChemIDplus
hexan-2-ol UniProt
n-butylmethylcarbinol NIST Chemistry WebBook
n-C4H9CH(OH)CH3 NIST Chemistry WebBook
n-hexan-2-ol NIST Chemistry WebBook
sec-hexyl alcohol ChemIDplus
sec-hexyl alcohol NIST Chemistry WebBook
Manual Xrefs Databases
2-Hexanol Wikipedia
HMDB0061886 HMDB
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Registry Numbers Types Sources
626-93-7 CAS Registry Number NIST Chemistry WebBook
626-93-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
19038237 PubMed citation Europe PMC
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22936621 PubMed citation Europe PMC
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26369156 PubMed citation Europe PMC
26476310 PubMed citation Europe PMC
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IND601242539 Agricola citation Europe PMC
Last Modified
18 August 2020