基本情報
- CAS
80693-11-4- 標準SMILES
CCCCCCCCCCCCCCCCCCOC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1- InChIKey
SSDSCDGVMJFTEQ-UHFFFAOYSA-N- 分子式
- C35H62O3
- 平均分子量
- 530.9 g/mol
名称と識別子
- 優先名称
- Octadecyl DI-tert-butyl-4-hydroxyhydrocinnamate
- IUPAC
- octadecyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
- 英語名
- Stearyl beta-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate
- 分子式
- C35H62O3
- 分子量
- 0
名称と別名
Irganox 1076stearyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionateIRGANOX-1076TINOGARD TSV88J661G2POctadecyl DI-tert-butyl-4-hydroxyhydrocinnamateSELOSOL F 773SONGNOX 10763,5-Bis(1,1-dimethylethyl)-4-hydroxybenzenepropanoic acid octadecyl esterRefChem:7890082082-79-3Octadecyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate
名称をさらに表示
octadecyl 3-(4-hydroxy-3,5-ditert-butyl-phenyl)propanoateStearyl beta-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate
Antioxidant 1076octadecyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoateTominokusu SSNaugard 76Ralox 530Sumilizer BP 76Ultranox 276Irganox 1906
データベース識別子
- CAS
80693-11-4- UNII
- V88J661G2P
- EC Number
- 218-216-0
- Nikkaji
- J21.231H
物性
構造計算による物性
- XLogP
- 13.8
- 極性表面積
- 46.5 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 23
- 重原子数
- 38
- 形式電荷
- 0
- 複雑度
- 561
実験および物理化学的性質
Chemical Classes
Other Classes -> Other Aromatic Compounds
Antioxidant
Polymers
Plastics -> Antioxidants
Plastics -> Polyolefin-I; Polyolefin-II; PVC (soft); ABS; PVC (rigid); PMMA; PC; (E)PS
FragrancesFragrance Ingredient (Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, octadecyl ester) -> IFRA transparency List
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
Physical Description
Dry Powder; Liquid; Liquid; Large Crystals; Liquid; Wet Solid; CBI; Dry Powder; Other Solid
Irganox: White odorless solid; [HSDB] Solid; [IUCLID]
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 73.7% (1157 of 1569) of all reports.
Warning
H317 (19.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1569 reports by companies from 14 notifications to the ECHA C&L Inventory.
Warning
危険有害性情報
Regulatory Information
Chemical: Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, octadecyl ester
Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, octadecyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, octadecyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 19-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/15217
Hydrocinnamic acid, 3,5-di-t-butyl-4-hydroxy-, octadecyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, octadecyl ester: Human health tier I assessment
Hazards SummaryAn irritant; [MSDSonline]
Hazard Classes and Categories
Skin Sens. 1 (19.6%)
Reproductive toxicity - Category 2
安全と保護具
化学と産業
用途と製造
Uses
Irganox: Trademark for a series of complex, high-molecular-weight stabilizers that inhibit oxidation and thermal degradation of many organic materials. They contain multifunctional chemical groupings. Several are hindered polyphenols. [HSDB] Used in process that results in inclusion into or onto matrix; in polymers industry; as stabilizer; as antioxidant; [IUCLID]
Plastics -> Typical concentration range in plastic materials -> 0.002 - 0.4%
U.S. Production2023: 25,000,000 - <40,000,000 lb
Consumer UsesOther
Industry UsesOther
Household ProductsInformation on 11 consumer products that contain Hydrocinnamic acid, 3,5-di-t-butyl-4-hydroxy-, octadecyl ester in the following categories is provided:
Use Classification
Fragrance Ingredients
Plastics -> Polymer Type -> Polyolefin-I; Polyolefin-II; PVC (soft); ABS; PVC (rigid); PMMA; PC; (E)PS
Plastics -> Antioxidants
General Manufacturing Information
Asphalt Paving, Roofing, and Coating Materials Manufacturing
Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, octadecyl ester: ACTIVE
TRADEMARK FOR A SERIES OF COMPLEX, HIGH-MOLECULAR-WEIGHT STABILIZERS THAT INHIBIT OXIDATION AND THERMAL DEGRADATION OF MANY ORGANIC MATERIALS. THEY CONTAIN MULTIFUNCTIONAL CHEMICAL GROUPINGS. SEVERAL ARE HINDERED POLYPHENOLS. /IRGANOX/
サプライヤー1 社
HONEST JOY HOLDINGS LIMITED[email protected]
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