Basic information
- CAS
557-09-5- Standard SMILES
CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Zn+2]- InChIKey
CHJMFFKHPHCQIJ-UHFFFAOYSA-L- Molecular formula
- C16H30O4Zn
- Average molar mass
- 351.8 g/mol
- Monoisotopic mass
- 350.14355164
Names & identifiers
- Preferred name
- Zinc Caprylate
- IUPAC
- zinc bis(octanoate)
- English name
- ZINC CAPRYLATE
- Molecular formula
- C16H30O4Zn
- Molecular weight
- 351.8
Names & synonyms
Zinc caprylateZinc octanoateZinc dioctanoate557-09-5Zinc dioctylateZinc octoateZinc octylateOctanoic acid, zinc saltZinc(II) octoateOCTANOIC ACID, ZINC SALT (2:1)Zinc(2+) octanoateOctanoic acid zinc salt
Show more names
caprylateNsc63869Zinc &zincoctylateZincoctanoateZinkdioctanoat
DTXSID2042517Octanoic acid, zinc salt, basicEINECS 209-156-6EINECS 291-793-4NSC 63869QL5435GI2SEC 291-793-490480-58-3
Database identifiers
- CAS
557-09-5、90480-58-3- PubChem CID
- 11180
- DTXSID
DTXSID2042517- ChEMBL
CHEMBL3559812- UNII
- QL5435GI2S
- EC Number
- 209-156-6、291-793-4
- Nikkaji
- J54.269E
Properties
Computed structural properties
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 83.7
Experimental & physicochemical properties
Chemical ClassesMetals -> Organic Acids, Metal Salts
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionLustrous solid; [Merck Index] White powder; [Pfaltz and Bauer MSDS]
Physicochemical properties
- Melting point
- 136 ° · 136°
- Density
- 1.19 g/cm3 · 1.19 g/cm3
- Flash point
- 63 °C · 63.00°C
- solubility
- 2 O · slightly soluble in H2O
- form
- white hygroscopic crystals
- color
- white hygroscopic crystals, crystalline
- Water Solubility
- 2 O; · slightly soluble boiling H2O; soluble boiling alcohol [HAW93]
- Stability
- Stable. Avoid moisture.
- InChI
- InChI=1S/C6H8N2O/c1-4-3-5(2)7-8-6(4)9/h3,7H,2H2,1H3,(H,8,9)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 13.3% (28 of 210) of reports.
Warning
H302 (84.3%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 210 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
This chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.
Hazard information
Regulatory Information
Chemical: Octanoic acid, zinc salt
Chemical: Octanoic acid, zinc salt, basic
Status: Active Update: 30-04-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/11214
Status: Active Update: 15-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24877
Octanoic acid, zinc salt: Does not have an individual approval but may be used under an appropriate group standard
Octanoic acid, zinc salt, basic: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety Information
Evaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Evaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazards SummaryCauses muscle weakness, and diarrhea in oral lethal-dose studies of mice and rats; [RTECS] Decomposed by moist air evolving caprylic acid; [Merck Index] An irritant; [Pfaltz and Bauer MSDS] See Zinc. See Octanoic acid.
Chemistry & industry
Uses & manufacturing
Uses
Used as a fungicide on adhesive tape; [Merck Index]
Working with Glues and Adhesives [Category: Other]
General Manufacturing InformationOctanoic acid, zinc salt (2:1): ACTIVE
Applications
UsesAs fungicide like zinc propionate.
Suppliers55 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
武汉欣扬瑞和化学科技有限公司18171205315; 18171205315 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
Syntechem Co.,Ltd[email protected]
Related reactions
10 records
Compound notes
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