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Details

Stereochemistry ACHIRAL
Molecular Formula C7H8OS
Molecular Weight 140.203
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-PROPIONYLTHIOPHENE

SMILES

CCC(=O)C1=CC=CS1

InChI

InChIKey=MFPZQZZWAMAHOY-UHFFFAOYSA-N
InChI=1S/C7H8OS/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C7H8OS
Molecular Weight 140.203
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Prediction of genotoxicity of chemical compounds by statistical learning methods.
2005 Jun
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:15:14 GMT 2023
Edited
by admin
on Sat Dec 16 08:15:14 GMT 2023
Record UNII
NY658TVP5M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PROPIONYLTHIOPHENE
Systematic Name English
ETHYL 2-THIENYL KETONE
Systematic Name English
NSC-76041
Code English
1-PROPANONE, 1-(2-THIENYL)-
Systematic Name English
1-(2-THIENYL)-1-PROPANONE
Systematic Name English
1-(THIOPHEN-2-YL)PROPAN-1-ONE
Systematic Name English
2-PROPANOYLTHIOPHENE
Systematic Name English
Code System Code Type Description
FDA UNII
NY658TVP5M
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
PRIMARY
NSC
76041
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID70159933
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
PRIMARY
CAS
213611-32-6
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
SUPERSEDED
ECHA (EC/EINECS)
237-182-8
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
PRIMARY
CAS
13679-75-9
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
PRIMARY
PUBCHEM
26179
Created by admin on Sat Dec 16 08:15:14 GMT 2023 , Edited by admin on Sat Dec 16 08:15:14 GMT 2023
PRIMARY