Zinc Caprylate (HCID 11180)

이름 및 식별자

우선 이름: Zinc Caprylate
IUPAC: zinc bis(octanoate)
현지명: 옥토산 아연
영어명: ZINC CAPRYLATE
분자식: C16H30O4Zn
분자량: 351.8

이름 및 동의어

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

이름 더 보기

옥토산아연옥토산아연(ZINCOCTOATE)caprylateNsc63869Zinc &zincoctylateZincoctanoateZinkdioctanoat

DTXSID2042517Octanoic acid, zinc salt, basicEINECS 209-156-6EINECS 291-793-4NSC 63869QL5435GI2SEC 291-793-490480-58-3

데이터베이스 식별자

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

물성

구조 계산 물성

극성 표면적: 80.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 10
무거운 원자 수: 21
형식 전하: 0
복잡도: 83.7

실험 및 물리화학적 성질

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]

물리화학적 성질

녹는점: 136 ° · 136°
밀도: 1.19 g/cm3 · 1.19 g/cm3
인화점: 63 °C · 63.00°C
용해도: 2 O · slightly soluble in H2O
물리적 상태: 백색 흡습성 결정
색상: white hygroscopic crystals, crystalline
수용성: 2 O; · 약간 용해되는 끓는 H2O; 가용성 끓는 알코올 [HAW93]
안정성: 안정적인. 습기를 피하십시오.
InChI: InChI=1S/C6H8N2O/c1-4-3-5(2)7-8-6(4)9/h3,7H,2H2,1H3,(H,8,9)
InChIKey: CHJMFFKHPHCQIJ-UHFFFAOYSA-L
SMILES: [Zn](OC(=O)CCCCCCC)OC(=O)CCCCCCC
EPA: Zinc octanoate (557-09-5)

화학적 성질

Lustrous scales. Decomposes in moist atmosphere giving off caprylic acid. Slightly soluble in boiling water; fairly soluble in boiling alcohol.

안전 및 규제

GHS 분류

GHS Classification · 6건

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.

유해성 정보

Regulatory Information · 6건

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 · 2건

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.

Hazard Classes and Categories · 2건

Eye Irrit. 2 (75%)

Acute Tox. 4 (84.3%)

안전 및 보호

Exposure Control and Personal Protection0.1 [mg/m3] (respirable fraction), 2 mg/m3 (inhalable fraction) for Zn inorg. cmpnds[German Research Foundation (DFG)]