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Details

Stereochemistry ACHIRAL
Molecular Formula C9H13NO
Molecular Weight 151.2056
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ACETYL-2,4,5-TRIMETHYLPYRROLE

SMILES

CC(=O)C1=C(C)NC(C)=C1C

InChI

InChIKey=XVBRWTVSTZYJIB-UHFFFAOYSA-N
InChI=1S/C9H13NO/c1-5-6(2)10-7(3)9(5)8(4)11/h10H,1-4H3

HIDE SMILES / InChI

Molecular Formula C9H13NO
Molecular Weight 151.2056
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 Fri Dec 15 20:00:41 GMT 2023
Edited
by admin
on Fri Dec 15 20:00:41 GMT 2023
Record UNII
W5UKK6E72S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ACETYL-2,4,5-TRIMETHYLPYRROLE
Systematic Name English
KETONE, METHYL 2,4,5-TRIMETHYLPYRROL-3-YL
Systematic Name English
Code System Code Type Description
CAS
19005-95-9
Created by admin on Fri Dec 15 20:00:41 GMT 2023 , Edited by admin on Fri Dec 15 20:00:41 GMT 2023
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PUBCHEM
29375
Created by admin on Fri Dec 15 20:00:41 GMT 2023 , Edited by admin on Fri Dec 15 20:00:41 GMT 2023
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FDA UNII
W5UKK6E72S
Created by admin on Fri Dec 15 20:00:41 GMT 2023 , Edited by admin on Fri Dec 15 20:00:41 GMT 2023
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EPA CompTox
DTXSID10172469
Created by admin on Fri Dec 15 20:00:41 GMT 2023 , Edited by admin on Fri Dec 15 20:00:41 GMT 2023
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