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Details

Stereochemistry RACEMIC
Molecular Formula C7H11NO3
Molecular Weight 157.1671
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 3-cyano-3-hydroxybutanoate

SMILES

CCOC(=O)CC(C)(O)C#N

InChI

InChIKey=NRQQCDLVGWWNRQ-UHFFFAOYSA-N
InChI=1S/C7H11NO3/c1-3-11-6(9)4-7(2,10)5-8/h10H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H11NO3
Molecular Weight 157.1671
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:48:37 GMT 2023
Edited
by admin
on Sat Dec 16 18:48:37 GMT 2023
Record UNII
QP834AA6QA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl 3-cyano-3-hydroxybutanoate
Systematic Name English
Butyric acid, 3-cyano-3-hydroxy-, ethyl ester
Systematic Name English
3-Cyano-3-hydroxy-3-methyl-propionic acid ethyl ester
Systematic Name English
Ethyl acetoacetate cyanohydrin
Common Name English
Butanoic acid, 3-cyano-3-hydroxy-, ethyl ester
Systematic Name English
NSC-47019
Code English
Code System Code Type Description
EPA CompTox
DTXSID90286679
Created by admin on Sat Dec 16 18:48:37 GMT 2023 , Edited by admin on Sat Dec 16 18:48:37 GMT 2023
PRIMARY
CAS
6330-37-6
Created by admin on Sat Dec 16 18:48:37 GMT 2023 , Edited by admin on Sat Dec 16 18:48:37 GMT 2023
PRIMARY
PUBCHEM
240598
Created by admin on Sat Dec 16 18:48:37 GMT 2023 , Edited by admin on Sat Dec 16 18:48:37 GMT 2023
PRIMARY
NSC
47019
Created by admin on Sat Dec 16 18:48:37 GMT 2023 , Edited by admin on Sat Dec 16 18:48:37 GMT 2023
PRIMARY
FDA UNII
QP834AA6QA
Created by admin on Sat Dec 16 18:48:37 GMT 2023 , Edited by admin on Sat Dec 16 18:48:37 GMT 2023
PRIMARY