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Details

Stereochemistry ACHIRAL
Molecular Formula C14H18O4
Molecular Weight 250.2903
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diethyl methyl(phenyl)malonate

SMILES

CCOC(=O)C(C)(C(=O)OCC)C1=CC=CC=C1

InChI

InChIKey=KGUIOHXCGVQYEG-UHFFFAOYSA-N
InChI=1S/C14H18O4/c1-4-17-12(15)14(3,13(16)18-5-2)11-9-7-6-8-10-11/h6-10H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C14H18O4
Molecular Weight 250.2903
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 19:04:33 GMT 2023
Edited
by admin
on Sat Dec 16 19:04:33 GMT 2023
Record UNII
UU4Q9WA4YZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Diethyl methyl(phenyl)malonate
Systematic Name English
Propanedioic acid, methylphenyl-, diethyl ester
Systematic Name English
Diethyl 2-methyl-2-phenylmalonate
Systematic Name English
Diethyl methylphenylmalonate
Systematic Name English
Propanedioic acid, 2-methyl-2-phenyl-, 1,3-diethyl ester
Systematic Name English
NSC-147481
Code English
Malonic acid, methylphenyl-, diethyl ester
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
251-789-5
Created by admin on Sat Dec 16 19:04:33 GMT 2023 , Edited by admin on Sat Dec 16 19:04:33 GMT 2023
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NSC
147481
Created by admin on Sat Dec 16 19:04:33 GMT 2023 , Edited by admin on Sat Dec 16 19:04:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID20187620
Created by admin on Sat Dec 16 19:04:33 GMT 2023 , Edited by admin on Sat Dec 16 19:04:33 GMT 2023
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FDA UNII
UU4Q9WA4YZ
Created by admin on Sat Dec 16 19:04:33 GMT 2023 , Edited by admin on Sat Dec 16 19:04:33 GMT 2023
PRIMARY
CAS
34009-61-5
Created by admin on Sat Dec 16 19:04:33 GMT 2023 , Edited by admin on Sat Dec 16 19:04:33 GMT 2023
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PUBCHEM
98549
Created by admin on Sat Dec 16 19:04:33 GMT 2023 , Edited by admin on Sat Dec 16 19:04:33 GMT 2023
PRIMARY