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Details

Stereochemistry ACHIRAL
Molecular Formula C6H7NO2
Molecular Weight 125.1253
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(5-Methylisoxazol-3-yl)ethanone

SMILES

CC(=O)C1=NOC(C)=C1

InChI

InChIKey=KYVXYWKQFCSMHL-UHFFFAOYSA-N
InChI=1S/C6H7NO2/c1-4-3-6(5(2)8)7-9-4/h3H,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H7NO2
Molecular Weight 125.1253
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:35:23 GMT 2023
Edited
by admin
on Sat Dec 16 15:35:23 GMT 2023
Record UNII
KZT7F73EXJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(5-Methylisoxazol-3-yl)ethanone
Systematic Name English
3-Acetyl-5-methylisoxazole
Systematic Name English
Methyl 5-methyl-3-isoxazolyl ketone
Common Name English
Ketone, methyl 5-methyl-3-isoxazolyl
Common Name English
1-(5-Methyl-1,2-oxazol-3-yl)ethan-1-one
Systematic Name English
Ethanone, 1-(5-methyl-3-isoxazolyl)-
Systematic Name English
1-(5-Methyl-1,2-isoxazol-3-yl)ethanone
Systematic Name English
Code System Code Type Description
PUBCHEM
11147714
Created by admin on Sat Dec 16 15:35:23 GMT 2023 , Edited by admin on Sat Dec 16 15:35:23 GMT 2023
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FDA UNII
KZT7F73EXJ
Created by admin on Sat Dec 16 15:35:23 GMT 2023 , Edited by admin on Sat Dec 16 15:35:23 GMT 2023
PRIMARY
CAS
24068-54-0
Created by admin on Sat Dec 16 15:35:23 GMT 2023 , Edited by admin on Sat Dec 16 15:35:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID60456822
Created by admin on Sat Dec 16 15:35:23 GMT 2023 , Edited by admin on Sat Dec 16 15:35:23 GMT 2023
PRIMARY