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Details

Stereochemistry ACHIRAL
Molecular Formula 2C7H5O2.Zn
Molecular Weight 307.636
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZINC BENZOATE

SMILES

[Zn++].[O-]C(=O)C1=CC=CC=C1.[O-]C(=O)C2=CC=CC=C2

InChI

InChIKey=JDLYKQWJXAQNNS-UHFFFAOYSA-L
InChI=1S/2C7H6O2.Zn/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H,8,9);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H5O2
Molecular Weight 121.1134
Charge -1
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 Fri Dec 15 19:48:28 UTC 2023
Edited
by admin
on Fri Dec 15 19:48:28 UTC 2023
Record UNII
6S1JO8U0CK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZINC BENZOATE
Systematic Name English
BENZOIC ACID, ZINC SALT
Common Name English
NSC-176118
Code English
Code System Code Type Description
CAS
553-72-0
Created by admin on Fri Dec 15 19:48:29 UTC 2023 , Edited by admin on Fri Dec 15 19:48:29 UTC 2023
PRIMARY
FDA UNII
6S1JO8U0CK
Created by admin on Fri Dec 15 19:48:29 UTC 2023 , Edited by admin on Fri Dec 15 19:48:29 UTC 2023
PRIMARY
NSC
176118
Created by admin on Fri Dec 15 19:48:29 UTC 2023 , Edited by admin on Fri Dec 15 19:48:29 UTC 2023
PRIMARY
ECHA (EC/EINECS)
209-047-3
Created by admin on Fri Dec 15 19:48:29 UTC 2023 , Edited by admin on Fri Dec 15 19:48:29 UTC 2023
PRIMARY
EPA CompTox
DTXSID00890504
Created by admin on Fri Dec 15 19:48:29 UTC 2023 , Edited by admin on Fri Dec 15 19:48:29 UTC 2023
PRIMARY
PUBCHEM
160523
Created by admin on Fri Dec 15 19:48:29 UTC 2023 , Edited by admin on Fri Dec 15 19:48:29 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE