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Details

Stereochemistry RACEMIC
Molecular Formula C12H14N2O3
Molecular Weight 234.2512
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 3-oxo-2-(2-phenyldiazenyl)butanoate

SMILES

CCOC(=O)C(\N=N\C1=CC=CC=C1)C(C)=O

InChI

InChIKey=YBKOBYPTHJKDFK-BUHFOSPRSA-N
InChI=1S/C12H14N2O3/c1-3-17-12(16)11(9(2)15)14-13-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3/b14-13+

HIDE SMILES / InChI

Molecular Formula C12H14N2O3
Molecular Weight 234.2512
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:47:42 GMT 2025
Edited
by admin
on Tue Apr 01 19:47:42 GMT 2025
Record UNII
Q6V388V6X8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-17512
Preferred Name English
Ethyl 3-oxo-2-(2-phenyldiazenyl)butanoate
Systematic Name English
Acetoacetic acid, 2-(phenylazo)-, ethyl ester
Systematic Name English
Butanoic acid, 3-oxo-2-(2-phenyldiazenyl)-, ethyl ester
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
226-751-6
Created by admin on Tue Apr 01 19:47:42 GMT 2025 , Edited by admin on Tue Apr 01 19:47:42 GMT 2025
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PUBCHEM
21615
Created by admin on Tue Apr 01 19:47:42 GMT 2025 , Edited by admin on Tue Apr 01 19:47:42 GMT 2025
PRIMARY
FDA UNII
Q6V388V6X8
Created by admin on Tue Apr 01 19:47:42 GMT 2025 , Edited by admin on Tue Apr 01 19:47:42 GMT 2025
PRIMARY
CAS
5462-33-9
Created by admin on Tue Apr 01 19:47:42 GMT 2025 , Edited by admin on Tue Apr 01 19:47:42 GMT 2025
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EPA CompTox
DTXSID501271598
Created by admin on Tue Apr 01 19:47:42 GMT 2025 , Edited by admin on Tue Apr 01 19:47:42 GMT 2025
PRIMARY
NSC
17512
Created by admin on Tue Apr 01 19:47:42 GMT 2025 , Edited by admin on Tue Apr 01 19:47:42 GMT 2025
PRIMARY