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Details

Stereochemistry ACHIRAL
Molecular Formula C12H20O5
Molecular Weight 244.2842
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((2-Methyl-1-oxoallyl)oxy)ethyl 6-hydroxyhexanoate

SMILES

CC(=C)C(=O)OCCOC(=O)CCCCCO

InChI

InChIKey=IHYBDNMNEPKOEB-UHFFFAOYSA-N
InChI=1S/C12H20O5/c1-10(2)12(15)17-9-8-16-11(14)6-4-3-5-7-13/h13H,1,3-9H2,2H3

HIDE SMILES / InChI

Molecular Formula C12H20O5
Molecular Weight 244.2842
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 Tue Apr 01 19:26:06 GMT 2025
Edited
by admin
on Tue Apr 01 19:26:06 GMT 2025
Record UNII
69DXD2UV92
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((2-Methyl-1-oxoallyl)oxy)ethyl 6-hydroxyhexanoate
Systematic Name English
2-[(2-Methyl-1-oxo-2-propen-1-yl)oxy]ethyl 6-hydroxyhexanoate
Preferred Name English
Hexanoic acid, 6-hydroxy-, 2-[(2-methyl-1-oxo-2-propen-1-yl)oxy]ethyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
69DXD2UV92
Created by admin on Tue Apr 01 19:26:06 GMT 2025 , Edited by admin on Tue Apr 01 19:26:06 GMT 2025
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EPA CompTox
DTXSID40234206
Created by admin on Tue Apr 01 19:26:06 GMT 2025 , Edited by admin on Tue Apr 01 19:26:06 GMT 2025
PRIMARY
PUBCHEM
3020350
Created by admin on Tue Apr 01 19:26:06 GMT 2025 , Edited by admin on Tue Apr 01 19:26:06 GMT 2025
PRIMARY
CAS
85099-10-1
Created by admin on Tue Apr 01 19:26:06 GMT 2025 , Edited by admin on Tue Apr 01 19:26:06 GMT 2025
PRIMARY
ECHA (EC/EINECS)
285-463-9
Created by admin on Tue Apr 01 19:26:06 GMT 2025 , Edited by admin on Tue Apr 01 19:26:06 GMT 2025
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