Sodium 2-anthraquinonesulfonate (HCID 23661981)

名称と識別子

優先名称: Sodium 2-anthraquinonesulfonate
IUPAC: sodium 9,10-dioxoanthracene-2-sulfonate
現地名: アントラキノン-2-スルホン酸ナトリウム一水和物
英語名: Sodium anthraquinone-2-sulfonate
分子式: C14H9NaO5S
分子量: 311.27

名称と別名

131-08-8Sodium 2-anthraquinonesulfonateSodium 9,10-dioxo-9,10-dihydroanthracene-2-sulfonate2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium saltSodium 2-anthrachinonesulphonateAnthraquinone-2-sodium sulfonateDTXSID4044535UNII-511H72SDVX2-Anthraquinone sodium sulfonate2-Anthraquinonesulfonic acid sodium saltSodium beta-anthraquinonesulfonateEINECS 205-009-5

名称をさらに表示

アントラキノン-2-スルホン酸ナトリウム一水和物9,10-ジヒドロ9,10-ジオキソアントラセン-2-スルホン酸ナトリウム9,10-ジヒドロ-9,10-ジオキソアントラセン-2-スルホン酸ナトリウムアントラキノン-2-スルホン酸ナトリウム2-(ソジオオキシスルホニル)-9,10-アントラキノン9,10-ジオキソアントラセン-2-スルホン酸ナトリウム9,10-ジヒドロ-9,10-ジオキソ-2-アントラセンスルホン酸ナトリウム9,10-ジオキソ-2-アントラセンスルホン酸ナトリウム9,10-ジオキソ-9,10-ジヒドロアントラセン-2-スルホン酸ナトリウム9,10-ジオキソ-9,10-ジヒドロ-2-アントラセンスルホン酸ナトリウムアントラキノン-2-スルホン酸ナトリウム(アントラキノン-β-スルホン酸ナトリウム)ナトリウム＝9，10-ジオキソ-9，10-ジヒドロアントラセン-2-スルホナートアントラキノン‐2‐スルホン酸ナトリウム一水和物アントラキノン-Β-スルホン酸ナトリウム一水和物ナトリウム 9,10-ジオキソ-9,10-ジヒドロアントラセン-2-スルホナート9,10-ジオキソアントラセン-2-スルホン酸アニオン9,10-ジオキソ-9,10-ジヒドロアントラセン-2-スルホナート9,10-ジヒドロ-9,10-ジオキソアントラセン-2-スルホナート9,10-ジオキソアントラセン-2-スルホナートSodium anthraquinone-2-sulfonate monohydrate (2=β)ANTHRAQUINONE-2-SULFONIC ACID SODIUM SALTsilversaltAnthraquinone-2-sulfonicacid,2-anthraquinonesulfonatesodiumAnthraquinone-2-sulfLABOTEST-BB LT00159854sodium2-anthraquinonesulfonate

Anthraquinone-2-sulfonate sodium salt9,10-Anthraquinone-2-sodium sulfonate2-Anthraquinonesulfonate sodiumSodium 2-anthrachinonesulfonate511H72SDVXSodium-2-anthrachinonesulphonate2-Sulfoanthraquinone sodium saltDTXCID2024535

データベース識別子

CAS: 131-08-8
PubChem CID: 23661981
DTXSID: DTXSID4044535
ChEMBL: CHEMBL3184279
UNII: 511H72SDVX
EC Number: 205-009-5
Nikkaji: J79.454F

物性

構造計算による物性

極性表面積: 99.7 Å²
水素結合供与体数: 0
水素結合受容体数: 5
回転可能結合数: 1
重原子数: 21
形式電荷: 0
複雑度: 538

実験および物理化学的性質

Physical Description · 2 件

CBI

Beige powder; [Sigma-Aldrich MSDS]

物理化学的性質

融点: 300 °C · >300 °C(lit.)
比重(密度): 1.66 · 1.66[at 20℃]
蒸気圧: 0 Pa · 0Pa at 25℃
貯蔵温度: 30 °C · Store below +30°C.
外見: powder
酸解離定数(Pka): -1.8 · -1.8 (approx)
水溶解度: 熱水、冷水に溶け、アルコールやエーテルには溶けない。
BRN: 3580452 · 3580452
安定性: 安定。強力な酸化剤とは相容れない。
InChI: InChI=1S/C14H8O5S.Na.H/c15-13-9-3-1-2-4-10(9)14(16)12-7-8(20(17,18)19)5-6-11(12)13;;/h1-7H,(H,17,18,19);;
InChIKey: OOYZSHREGVYLQK-UHFFFAOYSA-N
SMILES: O=C1C2=CC=CC=C2C(=O)C2C=CC(S(O)(=O)=O)=CC1=2.[NaH]
LogP: -1.6 at · -1.6 at 25℃
CAS データベース: 131 · 131-08-8(CAS DataBase Reference)
EPAの化学物質情報: 2 · 2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (131-08-8)

化学的性質

化学的特性beige powder

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 57.6% (110 of 191) of all reports.

Warning

H315 (42.4%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (42.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (41.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 191 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 110 of 191 reports by companies.；There are 5 notifications provided by 81 of 191 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 4 件

Chemical: 2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt

2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:1) 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)

Status: Active Update: 13-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/25785

2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 件

Causes abnormal liver and kidney function tests in oral lethal-dose studies of guinea pigs; Causes changes in spleen weight, blood cell counts, and nucleated red blood cells in 30-day oral studies of rats; [RTECS] A skin and strong eye irritant; [Sigma-Aldrich MSDS] See Sodium anthraquinone-1-sulfonate.

Hazard Classes and CategoriesSkin Irrit. 2 (42.4%)；Eye Irrit. 2 (42.4%)；STOT SE 3 (41.9%)

毒性情報

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.

法規制情報

Regulatory Information · 4 件

Chemical: 2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt

2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:1) 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)

Status: Active Update: 13-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/25785

2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt: Does not have an individual approval but may be used under an appropriate group standard

安全データ

wgk: 3
tsca: TSCA listed
rtecs: CB1095550
hs_code: 29147090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36

化学と産業

用途と製造

U.S. Production2023: <75,000 lb；2022: <75,000 lb；2021: <75,000 lb；2020: <75,000 lb

Consumer UsesPigment

Industry UsesPigment

General Manufacturing Information · 2 件

Synthetic Dye and Pigment Manufacturing

2-Anthracenesulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:1): ACTIVE

調製方法

純化方法It crystallises from H2O or MeOH (charcoal). [Costa and Bookfield J Chem Soc, Faraday Trans 1 82 991 1986, Beilstein 11 IV 671.]

上流・下流製品情報

下流製品

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

アントラキノン-2-スルホン酸ナトリウム一水和物

基本情報