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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O3
Molecular Weight 208.2536
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-BUTOXYPHENYLACETIC ACID

SMILES

CCCCOC1=CC=C(CC(O)=O)C=C1

InChI

InChIKey=KLJMYYFCWBVKEE-UHFFFAOYSA-N
InChI=1S/C12H16O3/c1-2-3-8-15-11-6-4-10(5-7-11)9-12(13)14/h4-7H,2-3,8-9H2,1H3,(H,13,14)

HIDE SMILES / InChI

Molecular Formula C12H16O3
Molecular Weight 208.2536
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 12:05:50 UTC 2023
Edited
by admin
on Sat Dec 16 12:05:50 UTC 2023
Record UNII
5P55RDR58C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-BUTOXYPHENYLACETIC ACID
Systematic Name English
BENZENEACETIC ACID, P-BUTOXY-
Systematic Name English
P-BUTOXYPHENYLACETIC ACID
Systematic Name English
BENZENEACETIC ACID, 4-BUTOXY-
Systematic Name English
4-N-BUTOXYPHENYLACETIC ACID
Systematic Name English
BUFEXAMAC IMPURITY A [EP IMPURITY]
Common Name English
ACETIC ACID, (P-BUTOXYPHENYL)-
Systematic Name English
ACETIC ACID, (4-BUTOXYPHENYL)-
Systematic Name English
4-N-BUTOXYBENZENEACETIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00196518
Created by admin on Sat Dec 16 12:05:50 UTC 2023 , Edited by admin on Sat Dec 16 12:05:50 UTC 2023
PRIMARY
FDA UNII
5P55RDR58C
Created by admin on Sat Dec 16 12:05:50 UTC 2023 , Edited by admin on Sat Dec 16 12:05:50 UTC 2023
PRIMARY
ECHA (EC/EINECS)
224-904-1
Created by admin on Sat Dec 16 12:05:50 UTC 2023 , Edited by admin on Sat Dec 16 12:05:50 UTC 2023
PRIMARY
CAS
4547-57-3
Created by admin on Sat Dec 16 12:05:50 UTC 2023 , Edited by admin on Sat Dec 16 12:05:50 UTC 2023
PRIMARY
PUBCHEM
78304
Created by admin on Sat Dec 16 12:05:50 UTC 2023 , Edited by admin on Sat Dec 16 12:05:50 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY