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Details

Stereochemistry ACHIRAL
Molecular Formula C14H28O2
Molecular Weight 228.3709
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPROPYL UNDECANOATE

SMILES

CCCCCCCCCCC(=O)OC(C)C

InChI

InChIKey=KJRRQERTCPYNMS-UHFFFAOYSA-N
InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-11-12-14(15)16-13(2)3/h13H,4-12H2,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-METHYLETHYL UNDECANOATE
Preferred Name English
ISOPROPYL UNDECANOATE
Systematic Name English
UNDECANOIC ACID, 1-METHYLETHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
WZ4A7755HE
Created by admin on Tue Apr 01 17:36:45 GMT 2025 , Edited by admin on Tue Apr 01 17:36:45 GMT 2025
PRIMARY
CAS
50638-98-7
Created by admin on Tue Apr 01 17:36:45 GMT 2025 , Edited by admin on Tue Apr 01 17:36:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID90198682
Created by admin on Tue Apr 01 17:36:45 GMT 2025 , Edited by admin on Tue Apr 01 17:36:45 GMT 2025
PRIMARY
ECHA (EC/EINECS)
256-674-3
Created by admin on Tue Apr 01 17:36:45 GMT 2025 , Edited by admin on Tue Apr 01 17:36:45 GMT 2025
PRIMARY
PUBCHEM
3016538
Created by admin on Tue Apr 01 17:36:45 GMT 2025 , Edited by admin on Tue Apr 01 17:36:45 GMT 2025
PRIMARY
NIH
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