1,3-プロパンジスルホン酸 (5060%水溶液)

1,3-Propanedisulfonic acid

HCID 428573CAS 21668-77-9

基本情報

標準SMILES
O=S(=O)(O)CCCS(=O)(=O)O
InChIKey
MGNVWUDMMXZUDI-UHFFFAOYSA-N
分子式
C3H8O6S2
平均分子量
204.2 g/mol
単同位体質量
203.97623032

名称と識別子

優先名称
1,3-Propanedisulfonic acid
IUPAC
propane-1,3-disulfonic acid
現地名
1,3-プロパンジスルホン酸 (5060%水溶液)
英語名
Eprodisate
分子式
C3H8O6S2
分子量
204.22

名称と別名

Eprodisate21668-77-91,3-Propanedisulfonic acidPropane-1,3-disulfonateEprodisatoPropane-1,3-disulphonate6QFP76V7S7eprodisatumRefChem:590996propane-1,3-disulfonic acid1,3-Propanedisulfonic Acid (50-60% in Water)Eprodisate [INN]
名称をさらに表示
1,3-プロパンジスルホン酸 (5060%水溶液)1,3-プロパンジスルホン酸 (50-60%水溶液)1,3-プロパンジスルホン酸,70%W/V水溶液1,3-プロパンジスルホン酸二ナトリウム塩1,3-プロパンジスルホン酸3-スルホプロパン-1-スルホン酸プロパン-1,3-ジスルホン酸(50-60% in Water)propane-1,3-disulfonicaciDISODIUM 1,3-PROPANEDISULFONATE1,3-Propanedisulfonic Acid DISODIUM 1,3-PROPANEDISULPHONATEDISODIUM PROPANE-1,3-DISULFONATE1,3-PROPANEDISULFONIC ACID DISODIUM SALT
MFCD00191482starbld000931250-60% in Water1,3-propanesulfonic acid1,3-propanedisulphonic acidEPRODISATE [WHO-DD]UNII-6QFP76V7S7SCHEMBL34216

データベース識別子

CAS
21668-77-9
PubChem CID
428573
DTXSID
DTXSID4048301
ChEMBL
CHEMBL2111092
UNII
6QFP76V7S7
EC Number
679-154-1
Nikkaji
J534.155H

物性

構造計算による物性

XLogP
-1.6
極性表面積
126 Ų
水素結合供与体数
2
水素結合受容体数
6
回転可能結合数
4
重原子数
11

物理化学的性質

融点
120 · 120-124 ºC
沸点
157 °C · 157 °C(Press: 1.4 Torr)
比重(密度)
1.33 · 1.33
屈折率
1.422 · 1.4220
貯蔵温度
-20 °C · Store at -20°C
溶解性
125 mg/mL · DMSO: ≥ 125 mg/mL (612.09 mM)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (88.4%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (88.4%): Harmful in contact with skin [Warning Acute toxicity, dermal];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H332 (88.4%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;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

Hazard Classes and CategoriesAcute Tox. 4 (88.4%);Acute Tox. 4 (88.4%);Skin Corr. 1B (100%);Acute Tox. 4 (88.4%)

安全データ

wgk
3
ridadr
3265
hs_code
2904.10.5000
risk_code
36/37/38-34-20/21/22
化審法
(2)-4184
hazard_code
Xi,C

化学と産業

薬理情報

Mechanism of Action · 1 件

Decline in renal function associated with Amyloid A (AA) amyloidosis can be slowed by eprodisate (Kiacta), a drug that inhibits the deposit of the complex protein in tissues. AA amyloidosis is a serious, frequently fatal disorder involving deposits of amyloid fibrils in various organs and tissues. It is a complication of many chronic inflammatory disorders, but little is known about its etiology or natural history. Eprodisate delays the progression of AA amyloidosis-associated renal disease.

応用分野

使用Treatment of secondary (AA) amyloidosis.

サプライヤー43 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
宁波君龙新材料有限公司0574 88552216 19032109277 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

関連反応

1 件

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