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Octanal

  • Formula: C8H16O

  • Molecular weight: 128.21

  • Smiles: CCCCCCCC=O

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Octanal

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
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Names

  • Mycotoxin name: Octanal

  • First synonym: Octanal

  • Synonyms: Octanal,Caprylaldehyde,124-13-0,Caprylic aldehyde,n-Octanal,1-octanal,n-Octyl aldehyde,n-Octaldehyde,n-Caprylaldehyde,Octanaldehyde,n-Octylal,Aldehyde C-8,Octanoic aldehyde,Octyl aldehyde,OCTYLALDEHYDE,C-8 aldehyde,Octaldehyde,1-Octylaldehyde,1-Octaldehyde,1-Caprylaldehyde,n-Octanaldehyde,Antifoam-LF,Aldehyde C8,Oktylaldehyd,Oktanal,Octanal, tech.,Caprylaldehyd,Kaprylaldehyd,Octylaldehyd,NSC 1508,UNII-XGE9999H19,ALDEHIDO C-8,MFCD00007029,CHEMBL18407,CHEBI:17935,NSC1508,XGE9999H19,DSSTox_CID_1643,WLN: VH7,DSSTox_RID_76257,DSSTox_GSID_21643,Octanal (natural),Albumin tannate,Octyl aldehydes,CAS-124-13-0,FEMA No. 2797,HSDB 5147,EINECS 204-683-8,BRN 1744086,n-octylaldehyde,Capryl aldehyde,AI3-03961,n -octanal,octan-1-one,octan-8-one,OYA,Octanal, 99%,ACMC-1BNV4,bmse000851,EC 204-683-8,Octanal, analytical standard,SCHEMBL28601,4-01-00-03337 (Beilstein Handbook Reference),QSPL 183,DTXSID3021643,NSC8969,Octanal, >=95%, FCC, FG,NSC-1508,NSC-8969,STR04459,ZINC1529222,Tox21_201415,Tox21_300337,BDBM50028817,LMFA06000028,SBB059871,AKOS009031567,MCULE-7111365457,Octanal, natural, >=95%, FCC, FG,NCGC00247997-01,NCGC00247997-02,NCGC00254427-01,NCGC00258966-01,U306,FT-0626917,FT-0631629,FT-0631722,FT-0673199,O0044,ST51046136,EN300-19768,C01545,97569-EP2305662A1,97569-EP2374783A1,97569-EP2377841A1,97723-EP2287158A1,97723-EP2305662A1,Q416673,J-660019,Q-200605

Identifiers / External links

Structure

  • Smiles: CCCCCCCC=O

  • Isomeric smiles: CCCCCCCC=O

  • Inchi: InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h8H,2-7H2,1H3

  • Inchikey: NUJGJRNETVAIRJ-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C8H16O

  • Molecular weight: 128.21

  • Monoisotopic mass: 128.12011513

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