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Details

Stereochemistry RACEMIC
Molecular Formula C6H14O
Molecular Weight 102.1748
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-1-PENTANOL

SMILES

CCC(C)CCO

InChI

InChIKey=IWTBVKIGCDZRPL-UHFFFAOYSA-N
InChI=1S/C6H14O/c1-3-6(2)4-5-7/h6-7H,3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H14O
Molecular Weight 102.1748
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Volatile metabolite production of spoilage micro-organisms on a mixed-lettuce agar during storage at 7 degrees C in air and low oxygen atmosphere.
2006 Nov 1
Characterization of the most odor-active volatiles of orange wine made from a Turkish cv. Kozan (Citrus sinensis L. Osbeck).
2008 Jan 9
Metabolic engineering for production of biorenewable fuels and chemicals: contributions of synthetic biology.
2010
Fragrance material review on 3-methyl-1-pentanol.
2010 Jul
Male and female noctuid moths attracted to synthetic lures in Europe.
2010 Jun
Substance Class Chemical
Created
by admin
on Fri Dec 15 20:11:23 UTC 2023
Edited
by admin
on Fri Dec 15 20:11:23 UTC 2023
Record UNII
N8W93SI0FS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-1-PENTANOL
Systematic Name English
(±)-3-METHYL-1-PENTANOL
Systematic Name English
3-ETHYL-1-BUTANOL
Systematic Name English
(DL)-3-METHYLPENTYL ALCOHOL
Common Name English
FEMA NO. 3762
Code English
3-METHYLPENTANOL
Systematic Name English
NSC-9466
Code English
2-ETHYL-4-BUTANOL
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 3-METHYL-1-PENTANOL
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
Code System Code Type Description
ECHA (EC/EINECS)
209-644-9
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY
NSC
9466
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY
JECFA MONOGRAPH
417
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
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MESH
C481840
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY
PUBCHEM
11508
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
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FDA UNII
N8W93SI0FS
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID20862248
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY
CAS
589-35-5
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY
WIKIPEDIA
3-METHYL-1-PENTANOL
Created by admin on Fri Dec 15 20:11:23 UTC 2023 , Edited by admin on Fri Dec 15 20:11:23 UTC 2023
PRIMARY