Pigment Yellow 147

HCID 77767CAS 4118-16-5

基本情報

標準SMILES: O=C1c2ccccc2C(=O)c2c(Nc3nc(Nc4cccc5c4C(=O)c4ccccc4C5=O)nc(-c4ccccc4)n3)cccc21
InChIKey: MVIFQPPFCHUSIH-UHFFFAOYSA-N
分子式: C37H21N5O4
平均分子量: 599.6 g/mol
単同位体質量: 599.15935415

名称と識別子

優先名称: Pigment Yellow 147
IUPAC: 1-[[4-[(9,10-dioxoanthracen-1-yl)amino]-6-phenyl-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione

名称と別名

Cromophtal yellow AGRUNII-LQ3G1P1NFNLQ3G1P1NFNEINECS 223-912-21,1'-((6-Phenyl-1,3,5-triazine-2,4-diyl)diimino)bisanthraquinoneFILESTER YELLOW RNEC 223-912-2KAYASET YELLOW E-AR9,10-Anthracenedione, 1,1'-((6-phenyl-1,3,5-triazine-2,4-diyl)diimino)bis-FILESTER YELLOW 2648ADTXSID6052083CI 60645

名称をさらに表示

C.I. 606451,1'-[(6-Phenyl-1,3,5-triazine-2,4-diyl)diimino]bisanthraquinone9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis-1,1'-((6-PHENYL-1,3,5-TRIAZINE-2,4-DIYL)DIIMINO)BIS-9,10-ANTHRACENEDIONERefChem:17423476168-75-7DTXCID1030650PY 147

データベース識別子

CAS: 4118-16-5、76168-75-7
PubChem CID: 77767
DTXSID: DTXSID6052083
UNII: LQ3G1P1NFN
EC Number: 223-912-2、616-297-0
Nikkaji: J224.924C

物性

構造計算による物性

XLogP: 8.4
極性表面積: 131 Å²
水素結合供与体数: 2
水素結合受容体数: 9
回転可能結合数: 5
重原子数: 46
形式電荷: 0
複雑度: 1,110

実験および物理化学的性質

Food Contact Substances · 2 件

FCS -> FDA Cumulative Estimated Daily Intake (CEDI)

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

Physical DescriptionCBI

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 100% (2202 of 2202) of all reports.

Not Classified

Aggregated GHS information provided per 2202 reports by companies from 2 notifications to the ECHA C&L Inventory.

危険有害性情報

Regulatory Information · 4 件

Chemical: 9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis-

9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis- 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: 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bisanthraquinone (EC: 223-912-2)

9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesNot Classified

化学と産業

用途と製造

U.S. Production2023: <75,000 lb

Consumer UsesPigment

Industry UsesPigment

General Manufacturing Information · 2 件

Printing Ink Manufacturing

9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis-: ACTIVE