基本情報
- CAS
72102-84-2- 標準SMILES
Cc1cc2[nH]c(=O)[nH]c2cc1N=NC1C(=O)NC(=O)NC1=O- InChIKey
RITYHZCLJGBCAJ-UHFFFAOYSA-N- 分子式
- C12H10N6O4
- 平均分子量
- 302.25 g/mol
- 単同位体質量
- 302.07635282
名称と識別子
- 優先名称
- 5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]barbituric acid
- IUPAC
- 5-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)diazenyl]-1,3-diazinane-2,4,6-trione
- 現地名
- 5-[[(2,3-ジヒドロ-6-メチル-2-オキソ-1H-ベンゾイミダゾール)-5-イル]アゾ]-2,4,6(1H,3H,5H)-ピリミジントリオン
- 英語名
- Pigment Orange 64
- 分子式
- C12H10N6O4
- 分子量
- 302.25
名称と別名
5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]barbituric acidDTXSID60725025-((2,3-Dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo)barbituric acid2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-((2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo)-2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]-RefChem:528510DTXCID70472232,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo-72102-84-2RSE7HB753B5-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)diazenyl]-1,3-diazinane-2,4,6-trione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2-(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)diazenyl)-
名称をさらに表示
5-(6-メチル-2-オキソ-2,3-ジヒドロ-1H-ベンゾイミダゾール-5-イルアゾ)-1,2,3,4,5,6-ヘキサヒドロピリミジン-2,4,6-トリオン5-(6-メチル-2-オキソ-2,3-ジヒドロ-1H-ベンゾイミダゾール-5-イルアゾ)ヘキサヒドロピリミジン-2,4,6-トリオン5-[[(2,3-ジヒドロ-6-メチル-2-オキソ-1H-ベンゾイミダゾール)-5-イル]アゾ]-2,4,6(1H,3H,5H)-ピリミジントリオン5-（6-メチル-2-オキソ-2，3-ジヒドロ-5-ベンズイミダゾリルアゾ）ペルヒドロピリミジン-2，4，6-トリオン
物性
構造計算による物性
- XLogP
- -0.1
- 極性表面積
- 141 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
- 22
- 形式電荷
- 0
- 複雑度
- 556
実験および物理化学的性質
Polymers
Plastics -> Polyolefin-I; PUR; Polyolefin-II; PVC (soft); ABS; PVC (rigid); PET; PMMA; PA; PC; (E)PS
Plastics -> Pigments agents
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionDry Powder; Liquid; Dry Powder; CBI
物理化学的性質
- 比重(密度)
- 1.92 · 1.92
- 酸解離定数(Pka)
- 0.59 · 0.59±0.20(Predicted)
- EPAの化学物質情報
- 2 · 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]- (72102-84-2)
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% (258 of 258) of all reports.
Not Classified
Aggregated GHS information provided per 258 reports by companies from 2 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]-
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[2-(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)diazenyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[2-(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)diazenyl]- 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)
REACH registered substance: 5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]barbituric acid (EC: 276-344-2)
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo-: 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 InformationIMAP assessments - 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)azo]-: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
安全データ
- tsca
- TSCA listed
- 化審法
- 新規公示化学物質（2011年3月31日以前届出）
化学と産業
用途と製造
UsesPlastics -> Typical concentration range in plastic materials -> 2%
U.S. Production2023: 100,000 - <250,000 lb
Consumer UsesSolvent
Industry UsesSolvent
Use Classification
Plastics -> Pigments agents
Plastics -> Polymer Type -> Polyolefin-I; PUR; Polyolefin-II; PVC (soft); ABS; PVC (rigid); PET; PMMA; PA; PC; (E)PS
General Manufacturing Information
Printing Ink Manufacturing
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[2-(2,3-dihydro-6-methyl-2-oxo-1H-benzimidazol-5-yl)diazenyl]-: ACTIVE
サプライヤー27 社
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
超彩实业有限公司0574-83851061 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
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