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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O
Molecular Weight 142.2386
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-METHYLOCTANAL

SMILES

CCC(C)CCCCC=O

InChI

InChIKey=ANZKSSJWPUCGOP-UHFFFAOYSA-N
InChI=1S/C9H18O/c1-3-9(2)7-5-4-6-8-10/h8-9H,3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H18O
Molecular Weight 142.2386
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 21:16:37 GMT 2023
Edited
by admin
on Fri Dec 15 21:16:37 GMT 2023
Record UNII
369IPU68IF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-METHYLOCTANAL
Systematic Name English
6-METHYLOCTANAL, (±)-
Systematic Name English
(±)-6-METHYLOCTANAL
Systematic Name English
6-METHYL OCTANAL
Systematic Name English
OCTANAL, 6-METHYL-
Systematic Name English
FEMA NO. 4433
Code English
Classification Tree Code System Code
JECFA EVALUATION 6-METHYLOCTANAL
Created by admin on Fri Dec 15 21:16:37 GMT 2023 , Edited by admin on Fri Dec 15 21:16:37 GMT 2023
Code System Code Type Description
PUBCHEM
14297102
Created by admin on Fri Dec 15 21:16:37 GMT 2023 , Edited by admin on Fri Dec 15 21:16:37 GMT 2023
PRIMARY
JECFA MONOGRAPH
2149
Created by admin on Fri Dec 15 21:16:37 GMT 2023 , Edited by admin on Fri Dec 15 21:16:37 GMT 2023
PRIMARY
FDA UNII
369IPU68IF
Created by admin on Fri Dec 15 21:16:37 GMT 2023 , Edited by admin on Fri Dec 15 21:16:37 GMT 2023
PRIMARY
CAS
30689-75-9
Created by admin on Fri Dec 15 21:16:37 GMT 2023 , Edited by admin on Fri Dec 15 21:16:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID40952933
Created by admin on Fri Dec 15 21:16:37 GMT 2023 , Edited by admin on Fri Dec 15 21:16:37 GMT 2023
PRIMARY