基本情報
- CAS
28198-05-2- 標準SMILES
CCCCc1ccc(Nc2ccc(Nc3ccc(CCCC)cc3)c3c2C(=O)c2c(O)ccc(O)c2C3=O)cc1- InChIKey
KTEFLEFPDDQMCB-UHFFFAOYSA-N- 分子式
- C34H34N2O4
- 平均分子量
- 534.6 g/mol
- 単同位体質量
- 534.25185757
名称と識別子
- 優先名称
- 1,4-Bis(4-butylanilino)-5,8-dihydroxyanthraquinone
- IUPAC
- 1,4-bis(4-butylanilino)-5,8-dihydroxyanthracene-9,10-dione
- 英語名
- Solvent Green 28
- 分子式
- C28H22N2O4
- 分子量
- 450.492
名称と別名
名称をさらに表示
データベース識別子
- CAS
28198-05-2、71839-01-5- PubChem CID
- 119890
- DTXSID
DTXSID3067364- UNII
- L2KU3U5CCR
- EC Number
- 248-895-9、615-613-4
- Nikkaji
- J33.323I
物性
構造計算による物性
- XLogP
- 10.1
- 極性表面積
- 98.7 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
- 10
- 重原子数
- 40
- 形式電荷
- 0
- 複雑度
- 766
実験および物理化学的性質
物理化学的性質
- InChI
- InChI=1S/C28H22N2O4/c1-15-5-3-7-17(13-15)29-19-9-10-20(30-18-8-4-6-16(2)14-18)24-23(19)27(33)25-21(31)11-12-22(32)26(25)28(24)34/h3-14,29-32H,1-2H3
- InChIKey
- OCZLACZXYUWXDJ-UHFFFAOYSA-N
- SMILES
- C12C(=O)C3=C(C(O)=CC=C3O)C(=O)C=1C(=CC=C2NC1C=CC=C(C)C=1)NC1C=CC=C(C)C=1
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2297 of 2297) of all reports.
Not Classified
Aggregated GHS information provided per 2297 reports by companies from 1 notifications to the ECHA C&L Inventory.
This chemical does not meet GHS hazard criteria for 100% (24 of 24) of all reports.
Not Classified
Aggregated GHS information provided per 24 reports by companies from 1 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 9,10-Anthracenedione, 1,4-bis[(4-butylphenyl)amino]-5,8-dihydroxy-
REACH registered substance: 1,4-bis[(4-butylphenyl)amino]-5,8-dihydroxyanthraquinone (EC: 248-895-9)
9,10-Anthracenedione, 1,4-bis(4-butylphenyl)amino-5,8-dihydroxy-: 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 Categories
Not Classified
Not Classified
化学と産業
用途と製造
応用分野
使用Solvent Green 28 is used in coloring for transparent and opaque dyeing of PS, SAN, PMMA, PC, rigid PVC, CA, CAB and opaque dyeing of SB, ABS and ABS/PC blends.
調製方法
製造方法1,4,5,8-Tetrahydroxyanthracene-9,10-dione and Benzenamine,4-(1,1-dimethylethyl) (2 Moore) condensation.
サプライヤー53 社
関連反応
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化合物ノート
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