基本情報
- CAS
116821-35-3- 標準SMILES
CCCCC(CC)COC(=O)CSP(=O)(SCC(=O)OCC(CC)CCCC)SCC(=O)OCC(CC)CCCC- InChIKey
VCEOZBZYQYAEMK-UHFFFAOYSA-N- 分子式
- C30H57O7PS3
- 平均分子量
- 656.9 g/mol
- 単同位体質量
- 656.30040467
名称と識別子
- 優先名称
- 2-Ethylhexyl 10-ethyl-4-((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoate 4-oxide
- IUPAC
- 2-ethylhexyl 2-bis[[2-(2-ethylhexoxy)-2-oxoethyl]sulfanyl]phosphorylsulfanylacetate
- 現地名
- (10-エチル-4-[[2-[(2-エチルヘキシル)オキシ]-2-オキソエチル]チオ]-7-オキソ-8-オキサ-3,5-ジチア-4-ホスファテトラデカン酸4-オキシド)2-エチルヘキシル
- 英語名
- 2-ethylhexyl 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoate 4-oxide
- 分子式
- C30H57O7PS3
- 分子量
- 656.94
名称と別名
83547-95-9EINECS 280-479-22-Ethylhexyl 10-ethyl-4-((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoate 4-oxide8-Oxa-3,5-dithia-4-phosphatetradecanoic acid, 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-, 2-ethylhexyl ester, 4-oxideDTXSID30867825DTXSID402759128-Oxa-3,5-dithia-4-phosphatetradecanoic acid, 10-ethyl-4-((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)-7-oxo-, 2-ethylhexyl ester, 4-oxide116821-35-32-Ethylhexyl 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoate 4-oxideRefChem:471959DTXCID20227277DTXCID40815978
名称をさらに表示
(10-エチル-4-[[2-[(2-エチルヘキシル)オキシ]-2-オキソエチル]チオ]-7-オキソ-8-オキサ-3,5-ジチア-4-ホスファテトラデカン酸4-オキシド)2-エチルヘキシル2-Ethylhexyl-10-ethyl-4-((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoat-4-oxid(10-Ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoic acid 4-oxide)2-ethylhexyl ester
物性
構造計算による物性
- XLogP
- 9.8
- 極性表面積
- 172 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 10
- 回転可能結合数
- 30
- 重原子数
- 41
- 形式電荷
- 0
- 複雑度
- 658
物理化学的性質
- 沸点
- 200 ℃ · 200℃ at 101.325kPa
- 比重(密度)
- 1.06 at · 1.06 at 20℃
- 蒸気圧
- 0 Pa · 0Pa at 25℃
- 外見
- Liquid
- PH
- 3 at · 3 at 20℃ and 200g/L
- LogP
- 10.04 · 10.04
- EPAの化学物質情報
- 8 · 8-Oxa-3,5-dithia-4-phosphatetradecanoic acid, 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-, 2-ethylhexyl ester, 4-oxide (83547-95-9)
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P272, P273, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 8-Oxa-3,5-dithia-4-phosphatetradecanoic acid, 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-, 2-ethylhexyl ester, 4-oxide
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 2-ethylhexyl 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-8-oxa-3,5-dithia-4-phosphatetradecanoate 4-oxide (EC: 280-479-2)
8-Oxa-3,5-dithia-4-phosphatetradecanoic acid, 10-ethyl-4-2-(2-ethylhexyl)oxy-2-oxoethylthio-7-oxo-, 2-ethylhexyl ester, 4-oxide: 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.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
General Manufacturing Information8-Oxa-3,5-dithia-4-phosphatetradecanoic acid, 10-ethyl-4-[[2-[(2-ethylhexyl)oxy]-2-oxoethyl]thio]-7-oxo-, 2-ethylhexyl ester, 4-oxide: ACTIVE
サプライヤー1 社
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
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