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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H19ClO4
Molecular Weight 238.708
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Dimethylethyl (3R,5S)-6-chloro-3,5-dihydroxyhexanoate

SMILES

CC(C)(C)OC(=O)C[C@H](O)C[C@H](O)CCl

InChI

InChIKey=FIKPWJZUGTVXCO-SFYZADRCSA-N
InChI=1S/C10H19ClO4/c1-10(2,3)15-9(14)5-7(12)4-8(13)6-11/h7-8,12-13H,4-6H2,1-3H3/t7-,8+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(3R,5S)-6-Chloro-3,5-dihydroxyhexanoic acid tert-butyl ester
Preferred Name English
1,1-Dimethylethyl (3R,5S)-6-chloro-3,5-dihydroxyhexanoate
Systematic Name English
Hexanoic acid, 6-chloro-3,5-dihydroxy-, 1,1-dimethylethyl ester, (3R,5S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10431205
Created by admin on Wed Apr 02 19:46:28 GMT 2025 , Edited by admin on Wed Apr 02 19:46:28 GMT 2025
PRIMARY
CAS
154026-93-4
Created by admin on Wed Apr 02 19:46:28 GMT 2025 , Edited by admin on Wed Apr 02 19:46:28 GMT 2025
PRIMARY
PUBCHEM
9816157
Created by admin on Wed Apr 02 19:46:28 GMT 2025 , Edited by admin on Wed Apr 02 19:46:28 GMT 2025
PRIMARY
FDA UNII
WRH9M63WAE
Created by admin on Wed Apr 02 19:46:28 GMT 2025 , Edited by admin on Wed Apr 02 19:46:28 GMT 2025
PRIMARY
NIH
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