基本情報
- CAS
145017-98-7- 標準SMILES
O=S(=O)([O-])OCCS(=O)(=O)c1ccc(N=Nc2c(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])cc(Nc4nc(Cl)nc(Nc5cccc(S(=O)(=O)[O-])c5)n4)c3c2O)cc1.[Na+].[Na+].[Na+].[Na+]- InChIKey
ZRXRACPUMHCGPL-WPWJTNPYSA-J- 分子式
- C27H18ClN7Na4O16S5
- 平均分子量
- 984.2 g/mol
- 単同位体質量
- 982.8692882
名称と識別子
- 優先名称
- Reactive Red 198
- IUPAC
- tetrasodium;5-[[4-chloro-6-(3-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonate
- 現地名
- 5-[[4-クロロ-6-[(3-スルホフェニル)アミノ]-1,3,5-トリアジン-2-イル]アミノ]-4-ヒドロキシ-3-[[4-[[2-(スルホオキシ)エチル]スルホニル]フェニル]アゾ]-2,7-ナフタレンジスルホン酸/ナトリウム,(1:x)
- 英語名
- 5-[[4-chloro-6-[(3-sulphophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic acid, sodium salt
- 分子式
- C27H18ClN7Na4O16S5
- 分子量
- 984.2062
名称と別名
Reactive Red 19878952-61-1C.I. Reactive Red 198C.I. 1822184VM7N1390Remazol Red RB2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-, sodium salt2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium saltRemazol Red RB 133EINECS 279-015-1UNII-84VM7N1390REACTIVE RED RB
名称をさらに表示
5-[[4-クロロ-6-[(3-スルホフェニル)アミノ]-1,3,5-トリアジン-2-イル]アミノ]-4-ヒドロキシ-3-[[4-[[2-(スルホオキシ)エチル]スルホニル]フェニル]アゾ]-2,7-ナフタレンジスルホン酸/ナトリウム,(1:x)5-[[4-chloro-6-(3-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonate2,7-Naphthalenedisulfonic acid, 5-4-chloro-6-(3-sulfophenyl)amino-1,3,5-triazin-2-ylamino-4-hydroxy-3-4-2-(sulfooxy)ethylsulfonylphenylazo-, sodium salt
物性
構造計算による物性
- 極性表面積
- 422 Ų
- 水素結合供与体数
- 3
- 水素結合受容体数
- 23
- 回転可能結合数
- 10
- 重原子数
- 60
- 形式電荷
- 0
- 複雑度
- 1,890
物理化学的性質
- 沸点
- 1073.5 ℃[at · 1073.5℃[at 101 325 Pa]
- 比重(密度)
- 1.59 · 1.59[at 20℃]
- 水溶解度
- 123 g/L · 123g/L at 20℃
- LogP
- -2.43 at · -2.43 at 25℃
- EPAの化学物質情報
- 2 · 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt (78952-61-1)
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 83.3% (25 of 30) of all reports.
H412 (13.3%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 30 reports by companies from 4 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt
2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:?) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:?) 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-[[4-chloro-6-[(3-sulphophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic acid, sodium salt (EC: 279-015-1)
2,7-Naphthalenedisulfonic acid, 5-4-chloro-6-(3-sulfophenyl)amino-1,3,5-triazin-2-ylamino-4-hydroxy-3-4-2-(sulfooxy)ethylsulfonylphenylazo-, sodium salt: 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 - 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt: Human health tier I assessment
化学と産業
用途と製造
U.S. Production2022: 100,345 lb
Industry UsesDye
General Manufacturing Information
Textiles, apparel, and leather manufacturing
2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl]-, sodium salt (1:?): ACTIVE
サプライヤー9 社
艾吉析科技（上海）有限公司17717235263 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
ANHUI BYERSEN BIOTECH CO. LTD+8617355064950 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
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