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Details

Stereochemistry ACHIRAL
Molecular Formula 2C6H11O2.Zn
Molecular Weight 295.71
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZINC CAPROATE

SMILES

[Zn++].CCCCCC([O-])=O.CCCCCC([O-])=O

InChI

InChIKey=PKJOUIVGCFHFTK-UHFFFAOYSA-L
InChI=1S/2C6H12O2.Zn/c2*1-2-3-4-5-6(7)8;/h2*2-5H2,1H3,(H,7,8);/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 C6H11O2
Molecular Weight 115.1503
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Might be used as an ingredient of composition to prevent and control mouth odor, which is also effective in preventing calculus, plaque, caries and periodontal disease.

Approval Year

Unknown
139594
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Room temperature molecular and lattice structures of a homologous series of anhydrous zinc(II) n-alkanoate.
2007 Sep
FTIR, magnetic, 1H NMR spectral and thermal studies of some chelates of caproic acid: inhibitory effect on different kinds of bacteria.
2008 Jun
Patents

Patents

JP2001506283A
1
JP2011506618A
1
JPH00459850A
1
JPH02272047A
1
JPH04332748A
1
JPH0459850A
1
JPH1149516A
1
JPS6161227A
3
WO1998024426A1
1

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:18:49 UTC 2023
Edited
by admin
on Fri Dec 15 15:18:49 UTC 2023
Record UNII
4RZW5M35XM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZINC CAPROATE
Systematic Name English
CAPROIC ACID ZINC SALT
Common Name English
DIHEXANOIC ACID ZINC SALT
Common Name English
CAPROIC ACID, ZINC SALT
Common Name English
HEXANOIC ACID, ZINC SALT
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID20174858
Created by admin on Fri Dec 15 15:18:49 UTC 2023 , Edited by admin on Fri Dec 15 15:18:49 UTC 2023
PRIMARY
PUBCHEM
6432226
Created by admin on Fri Dec 15 15:18:49 UTC 2023 , Edited by admin on Fri Dec 15 15:18:49 UTC 2023
PRIMARY
CAS
20779-08-2
Created by admin on Fri Dec 15 15:18:49 UTC 2023 , Edited by admin on Fri Dec 15 15:18:49 UTC 2023
PRIMARY
FDA UNII
4RZW5M35XM
Created by admin on Fri Dec 15 15:18:49 UTC 2023 , Edited by admin on Fri Dec 15 15:18:49 UTC 2023
PRIMARY
Related Record Type Details
Structure of ZINC CATION
PARENT -> SALT/SOLVATE
Structure of CAPROIC ACID
PARENT -> SALT/SOLVATE
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