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Details

Stereochemistry ACHIRAL
Molecular Formula C8H16O2
Molecular Weight 144.2114
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 3,3-DIMETHYLBUTYRATE

SMILES

CCOC(=O)CC(C)(C)C

InChI

InChIKey=JWMNHAMYTBAUPI-UHFFFAOYSA-N
InChI=1S/C8H16O2/c1-5-10-7(9)6-8(2,3)4/h5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C8H16O2
Molecular Weight 144.2114
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 12:27:14 GMT 2023
Edited
by admin
on Sat Dec 16 12:27:14 GMT 2023
Record UNII
W67MQQ79JA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 3,3-DIMETHYLBUTYRATE
Systematic Name English
NSC-949
Code English
3,3-DIMETHYLBUTANOIC ACID ETHYL ESTER
Systematic Name English
ETHYL 3,3-DIMETHYLBUTANOATE
Systematic Name English
TERT-BUTYLACETIC ACID ETHYL ESTER
Systematic Name English
BUTANOIC ACID, 3,3-DIMETHYL-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
NSC
949
Created by admin on Sat Dec 16 12:27:14 GMT 2023 , Edited by admin on Sat Dec 16 12:27:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID50201565
Created by admin on Sat Dec 16 12:27:14 GMT 2023 , Edited by admin on Sat Dec 16 12:27:14 GMT 2023
PRIMARY
FDA UNII
W67MQQ79JA
Created by admin on Sat Dec 16 12:27:14 GMT 2023 , Edited by admin on Sat Dec 16 12:27:14 GMT 2023
PRIMARY
ECHA (EC/EINECS)
226-280-6
Created by admin on Sat Dec 16 12:27:14 GMT 2023 , Edited by admin on Sat Dec 16 12:27:14 GMT 2023
PRIMARY
PUBCHEM
79284
Created by admin on Sat Dec 16 12:27:14 GMT 2023 , Edited by admin on Sat Dec 16 12:27:14 GMT 2023
PRIMARY
CAS
5340-78-3
Created by admin on Sat Dec 16 12:27:14 GMT 2023 , Edited by admin on Sat Dec 16 12:27:14 GMT 2023
PRIMARY