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Details

Stereochemistry ACHIRAL
Molecular Formula C14H26O2
Molecular Weight 226.355
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Cyclohexylpropyl valerate

SMILES

CCCCC(=O)OCCCC1CCCCC1

InChI

InChIKey=ZUSLCRLGEUGVDK-UHFFFAOYSA-N
InChI=1S/C14H26O2/c1-2-3-11-14(15)16-12-7-10-13-8-5-4-6-9-13/h13H,2-12H2,1H3

HIDE SMILES / InChI

Molecular Formula C14H26O2
Molecular Weight 226.355
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 12:33:17 GMT 2023
Edited
by admin
on Sat Dec 16 12:33:17 GMT 2023
Record UNII
JTY32EXJ4D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Cyclohexylpropyl valerate
Systematic Name English
3-Cyclohexylpropyl pentanoate
Systematic Name English
Pentanoic acid, 3-cyclohexylpropyl ester
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
299-225-7
Created by admin on Sat Dec 16 12:33:17 GMT 2023 , Edited by admin on Sat Dec 16 12:33:17 GMT 2023
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CAS
93857-91-1
Created by admin on Sat Dec 16 12:33:17 GMT 2023 , Edited by admin on Sat Dec 16 12:33:17 GMT 2023
PRIMARY
FDA UNII
JTY32EXJ4D
Created by admin on Sat Dec 16 12:33:17 GMT 2023 , Edited by admin on Sat Dec 16 12:33:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID40239796
Created by admin on Sat Dec 16 12:33:17 GMT 2023 , Edited by admin on Sat Dec 16 12:33:17 GMT 2023
PRIMARY
PUBCHEM
3022685
Created by admin on Sat Dec 16 12:33:17 GMT 2023 , Edited by admin on Sat Dec 16 12:33:17 GMT 2023
PRIMARY