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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16ClFO2
Molecular Weight 246.706
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-chloro-1,1-dimethoxybutyl)-4-fluorobenzene

SMILES

COC(CCCCl)(OC)C1=CC=C(F)C=C1

InChI

InChIKey=STABNEURAMXABB-UHFFFAOYSA-N
InChI=1S/C12H16ClFO2/c1-15-12(16-2,8-3-9-13)10-4-6-11(14)7-5-10/h4-7H,3,8-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H16ClFO2
Molecular Weight 246.706
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 19:49:07 GMT 2023
Edited
by admin
on Sat Dec 16 19:49:07 GMT 2023
Record UNII
NV849B4CNH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-chloro-1,1-dimethoxybutyl)-4-fluorobenzene
Systematic Name English
1-(4-Fluorophenyl)-1,1-dimethoxy-4-chlorobutane
Systematic Name English
Benzene, 1-(4-chloro-1,1-dimethoxybutyl)-4-fluoro-
Systematic Name English
Code System Code Type Description
FDA UNII
NV849B4CNH
Created by admin on Sat Dec 16 19:49:07 GMT 2023 , Edited by admin on Sat Dec 16 19:49:07 GMT 2023
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CAS
57390-39-3
Created by admin on Sat Dec 16 19:49:07 GMT 2023 , Edited by admin on Sat Dec 16 19:49:07 GMT 2023
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PUBCHEM
11276673
Created by admin on Sat Dec 16 19:49:07 GMT 2023 , Edited by admin on Sat Dec 16 19:49:07 GMT 2023
PRIMARY