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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 isovalerate

SMILES

CC(C)CC(=O)OCCCC1CCCCC1

InChI

InChIKey=UBRSOJDKMYAROK-UHFFFAOYSA-N
InChI=1S/C14H26O2/c1-12(2)11-14(15)16-10-6-9-13-7-4-3-5-8-13/h12-13H,3-11H2,1-2H3

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 12:23:27 GMT 2023
Edited
by admin
on Sat Dec 16 12:23:27 GMT 2023
Record UNII
CS5VPQ5UQ8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Cyclohexylpropyl isovalerate
Systematic Name English
Butanoic acid, 3-methyl-, 3-cyclohexylpropyl ester
Systematic Name English
3-Cyclohexylpropyl 3-methylbutanoate
Systematic Name English
Code System Code Type Description
CAS
93857-92-2
Created by admin on Sat Dec 16 12:23:27 GMT 2023 , Edited by admin on Sat Dec 16 12:23:27 GMT 2023
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FDA UNII
CS5VPQ5UQ8
Created by admin on Sat Dec 16 12:23:27 GMT 2023 , Edited by admin on Sat Dec 16 12:23:27 GMT 2023
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PUBCHEM
3022686
Created by admin on Sat Dec 16 12:23:27 GMT 2023 , Edited by admin on Sat Dec 16 12:23:27 GMT 2023
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EPA CompTox
DTXSID00239797
Created by admin on Sat Dec 16 12:23:27 GMT 2023 , Edited by admin on Sat Dec 16 12:23:27 GMT 2023
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ECHA (EC/EINECS)
299-226-2
Created by admin on Sat Dec 16 12:23:27 GMT 2023 , Edited by admin on Sat Dec 16 12:23:27 GMT 2023
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