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Details

Stereochemistry MIXED
Molecular Formula C9H15IO3
Molecular Weight 298.1181
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 4-iodo-1-methoxycyclohexanecarboxylate

SMILES

COC(=O)C1(CCC(I)CC1)OC

InChI

InChIKey=XNIKLHLHHWFCPQ-UHFFFAOYSA-N
InChI=1S/C9H15IO3/c1-12-8(11)9(13-2)5-3-7(10)4-6-9/h7H,3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H15IO3
Molecular Weight 298.1181
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:30 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:30 GMT 2025
Record UNII
EP3B2QRQ5V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cyclohexanecarboxylic acid, 4-iodo-1-methoxy-, methyl ester
Preferred Name English
Methyl 4-iodo-1-methoxycyclohexanecarboxylate
Systematic Name English
Code System Code Type Description
CAS
2097133-18-9
Created by admin on Wed Apr 02 19:16:30 GMT 2025 , Edited by admin on Wed Apr 02 19:16:30 GMT 2025
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FDA UNII
EP3B2QRQ5V
Created by admin on Wed Apr 02 19:16:30 GMT 2025 , Edited by admin on Wed Apr 02 19:16:30 GMT 2025
PRIMARY
PUBCHEM
129073606
Created by admin on Wed Apr 02 19:16:30 GMT 2025 , Edited by admin on Wed Apr 02 19:16:30 GMT 2025
PRIMARY