1,3-Propanedisulfonic acid

HCID 428573CAS 21668-77-9

기본 정보

표준 SMILES
O=S(=O)(O)CCCS(=O)(=O)O
InChIKey
MGNVWUDMMXZUDI-UHFFFAOYSA-N
분자식
C3H8O6S2
평균 분자량
204.2 g/mol
단동위원소 질량
203.97623032

이름 및 식별자

우선 이름
1,3-Propanedisulfonic acid
IUPAC
propane-1,3-disulfonic acid
영어명
Eprodisate
분자식
C3H8O6S2
분자량
204.22

이름 및 동의어

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]
이름 더 보기
(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

데이터베이스 식별자

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

물성

구조 계산 물성

XLogP
-1.6
극성 표면적
126 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
11

물리화학적 성질

녹는점
120 · 120-124 ºC
끓는 점
157 °C · 157 °C(Press: 1.4 Torr)
밀도
1.33 · 1.33
굴절률
1.422 · 1.4220
저장 조건
-20 °C · Store at -20°C
용해도
125 mg/mL · DMSO: ≥ 125 mg/mL (612.09 mM)

안전 및 규제

GHS 분류

GHS Classification · 5건

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.

유해성 정보

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

안전 데이터

wgk
3
ridadr
3265
HS 번호
2904.10.5000
risk_code
36/37/38-34-20/21/22
hazard_code
Xi,C
safety_code
26-36-45-36/37/39-27

화학 및 산업

약리 정보

Mechanism of Action · 1건

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.

응용 분야

용도Treatment of secondary (AA) amyloidosis.

공급사43 곳

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]

관련 반응

1건

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