1,6-Bis((2,2-dimethyl-3-lauroyloxypropylidene)amino)hexane
基本情報
- CAS
613222-52-9- 標準SMILES
CCCCCCCCCCCC(=O)OCC(C)(C)C=NCCCCCCN=CC(C)(C)COC(=O)CCCCCCCCCCC- InChIKey
VSXDJUKBLDLTTB-UHFFFAOYSA-N- 分子式
- C40H76N2O4
- 平均分子量
- 649 g/mol
- 単同位体質量
- 648.58050891
名称と識別子
- 優先名称
- 1,6-Bis((2,2-dimethyl-3-lauroyloxypropylidene)amino)hexane
- IUPAC
- [3-[6-[(3-dodecanoyloxy-2,2-dimethylpropylidene)amino]hexylimino]-2,2-dimethylpropyl] dodecanoate
名称と別名
DTXSID50893540EC 479-930-81,6-Bis((2,2-dimethyl-3-lauroyloxypropylidene)amino)hexane1,6-Bis-((2,2-dimethyl-3-lauroyloxy-propylidene)-amino)hexaneDodecanoic acid, 1,1'-(1,6-hexanediylbis(nitrilo(2,2-dimethyl-1-propanyl-3-ylidene))) ester1,6-Bis-[(2,2-dimethyl-3-lauroyloxy-propylidene)-amino]hexaneDodecanoic acid, 1,1'-[1,6-hexanediylbis[nitrilo(2,2-dimethyl-1-propanyl-3-ylidene)]] esterRefChem:417531DTXCID701323563479-930-8613222-52-9SCHEMBL15511992
名称をさらに表示
VSXDJUKBLDLTTB-UHFFFAOYSA-NNS00009388[(Hexane-1,6-diyl)bis(azanylylidene)-2,2-dimethylpropan-1-yl-3-ylidene] didodecanoate
データベース識別子
- CAS
613222-52-9- PubChem CID
- 89999103
- DTXSID
DTXSID50893540- EC Number
- 479-930-8
- Nikkaji
- J3.782.155A
物性
構造計算による物性
- XLogP
- 12.7
- 極性表面積
- 77.3 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 6
- 回転可能結合数
- 35
- 重原子数
- 46
- 形式電荷
- 0
- 複雑度
- 711
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
Danger
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 53 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: Dodecanoic acid, 1,1'-[1,6-hexanediylbis[nitrilo(2,2-dimethyl-1-propanyl-3-ylidene)]] ester
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 1,6-Bis-[(2,2-dimethyl-3-lauroyloxy-propylidene)-amino]hexane (EC: 479-930-8)
Hardener LH (1,6-Hexanedialdimine): 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 Sens. 1B (100%)
化学と産業
用途と製造
General Manufacturing InformationDodecanoic acid, 1,1'-[1,6-hexanediylbis[nitrilo(2,2-dimethyl-1-propanyl-3-ylidene)]] ester: ACTIVE
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