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Details

Stereochemistry ACHIRAL
Molecular Formula C16H21ClO3
Molecular Weight 296.789
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[4-[2-(Acetyloxy)-1,1-dimethylethyl]phenyl]-4-chloro-1-butanone

SMILES

CC(=O)OCC(C)(C)C1=CC=C(C=C1)C(=O)CCCCl

InChI

InChIKey=ISMMBSJIVPORKU-UHFFFAOYSA-N
InChI=1S/C16H21ClO3/c1-12(18)20-11-16(2,3)14-8-6-13(7-9-14)15(19)5-4-10-17/h6-9H,4-5,10-11H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
1-[4-[2-(Acetyloxy)-1,1-dimethylethyl]phenyl]-4-chloro-1-butanone
Systematic Name English
2-[4-(4-Chlorobutanoyl)phenyl]-2-methylpropyl acetate
Systematic Name English
1-Butanone, 1-[4-[2-(acetyloxy)-1,1-dimethylethyl]phenyl]-4-chloro-
Systematic Name English
Code System Code Type Description
PUBCHEM
11011923
Created by admin on Sat Dec 16 19:17:14 UTC 2023 , Edited by admin on Sat Dec 16 19:17:14 UTC 2023
PRIMARY
FDA UNII
HV34PB4H8C
Created by admin on Sat Dec 16 19:17:14 UTC 2023 , Edited by admin on Sat Dec 16 19:17:14 UTC 2023
PRIMARY
CAS
169032-11-5
Created by admin on Sat Dec 16 19:17:14 UTC 2023 , Edited by admin on Sat Dec 16 19:17:14 UTC 2023
PRIMARY