Pigment Yellow 185
基本情報
- CAS
76199-85-4- 標準SMILES
CNC(=O)/C(C#N)=C1\N=C(c2c(O)[nH]c(=O)[nH]c2=O)c2ccccc21- InChIKey
SNZMGUPMUOWIDP-LUAWRHEFSA-N- 分子式
- C16H11N5O4
- 平均分子量
- 337.29 g/mol
- 単同位体質量
- 337.08110385
名称と識別子
- 優先名称
- Pigment Yellow 185
- IUPAC
- (2Z)-2-cyano-2-[3-(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)isoindol-1-ylidene]-N-methylacetamide
名称と別名
2-Cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methylacetamideEINECS 278-388-87CF7E3AUE4Enceprint Yellow 1155Paliotol Yellow D 1150Paliotol Yellow S 1155EC 278-388-8PY185Acetamide, 2-cyano-2-(2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene)-N-methyl-Acetamide, 2-cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methyl-2-Cyano-2-(2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene)-N-methylacetamideDTXSID7072836
名称をさらに表示
RefChem:863255DTXCID2047852278-388-8Acetamide, 2-cyano-2-2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene-N-methyl-76199-85-4UNII-7CF7E3AUE4SCHEMBL7150759SNZMGUPMUOWIDP-LUAWRHEFSA-N
データベース識別子
- CAS
76199-85-4- PubChem CID
- 3037059
- UNII
- 7CF7E3AUE4
- EC Number
- 278-388-8
- Nikkaji
- J2.958.308K
物性
構造計算による物性
- XLogP
- -0.3
- 極性表面積
- 144 Ų
- 水素結合供与体数
- 4
- 水素結合受容体数
- 6
- 回転可能結合数
- 2
- 重原子数
- 25
- 形式電荷
- 0
- 複雑度
- 814
実験および物理化学的性質
Physical DescriptionCBI; Dry Powder
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 100% (203 of 203) of all reports.
Not Classified
Aggregated GHS information provided per 203 reports by companies from 2 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: Acetamide, 2-cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methyl-
Acetamide, 2-cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Acetamide, 2-cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methyl- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 2-cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methylacetamide (EC: 278-388-8)
Acetamide, 2-cyano-2-2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene-N-methyl-: 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 CategoriesNot Classified
化学と産業
用途と製造
U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesPigment
Industry UsesPigment
General Manufacturing Information
Printing Ink Manufacturing
Acetamide, 2-cyano-2-[2,3-dihydro-3-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-1H-isoindol-1-ylidene]-N-methyl-: ACTIVE
関連反応
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化合物ノート
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