Grundinformationen
- CAS
15658-35-2- Standard-SMILES
O=C(O)c1ccc(SSc2ccc(C(=O)O)cn2)nc1- InChIKey
GSASOFRDSIKDSN-UHFFFAOYSA-N- Summenformel
- C12H8N2O4S2
- Durchschnittliche Molmasse
- 308,3 g/mol
- Monoisotopische Masse
- 307,99254909
Überblick
RN given refers to parent cpd; structure
Namen und Bezeichner
- Bevorzugter Name
- 6,6'-Dithiodinicotinic acid
- IUPAC
- 6-[(5-carboxy-2-pyridinyl)disulfanyl]pyridine-3-carboxylic acid
- Lokaler Name
- 6,6'-Dithiodinicotinsure
- Englischer Name
- 6,6'-Dithiodinicotinic acid
- Summenformel
- C12H8N2O4S2
- Molmasse
- 308.33
Namen und Synonyme
6,6'-Dithiodinicotinic acid15658-35-2CPDSCarboxypyridine disulfide6,6'-Dithiobis-3-pyridinecarboxylic acidDTXSID40166098RefChem:103747DTXCID6088589239-729-66,6'-Disulfanediyldinicotinic acid6-[(5-carboxypyridin-2-yl)disulfanyl]pyridine-3-carboxylic acid3-Pyridinecarboxylic acid, 6,6'-dithiobis-
Weitere Namen anzeigen
CPDS, 10 mM in DMSO6,6′-Dithiodinicotiniccarboxypyridinedisulfide6,6’-dithionicotinicacid6,6'-Dithiobisnicotinic acid6,6'-DithiodinicotinicAcid>6,6''-DITHIODINICOTINIC ACID 97+%
6,6'-Dithionicotinic acidMFCD00006454Nicotinic acid, 6,6'-dithiodi-NSC1477586,6'-Dithiobis(3-pyridinecarboxylic Acid)6,6 inverted exclamation marka-Dithiodinicotinic acidNSC-1477586-[(5-carboxy-2-pyridyl)disulfanyl]pyridine-3-carboxylic acid
Datenbank-Bezeichner
- CAS
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,6
- Polarare Oberfläche (TPSA)
- 151 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 335
Experimentelle und physikochemische Eigenschaften
Chemical ClassesNitrogen Compounds -> Pyridines
Physical DescriptionSolid; [Sigma-Aldrich MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 263 · 263-265 °C(lit.)
- Siedepunkt
- 584.2 · 584.2±50.0 °C(Predicted)
- Dichte
- 1.66 · 1.66±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- powder to crystal
- pka
- 2.82 · 2.82±0.10(Predicted)
- Farbe
- White to Light yellow
- Stabilität
- Stable. Incompatible with strong oxidizing agents.
- InChI
- 1S/C12H8N2O4S2/c15-11(16)7-1-3-9(13-5-7)19-20-10-4-2-8(6-14-10)12(17)18/h1-6H,(H,15,16)(H,17,18)
- InChIKey
- GSASOFRDSIKDSN-UHFFFAOYSA-N
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazards SummaryIntraperitoneal LD50 (mouse) >900 mg/kg; [RTECS] A skin and strong eye irritant; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2933399990
- RTECS-Nr.
- US5684700
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden6,6′-Dithiodinicotinic acid may be employed as:specific thiol blocker to investigate the radioprotective effect of mercaptoethylamine on the thiol level of the outer cell membrane of the Ehrlich ascites tumor cellsmodifier to investigate the polar microenvironment around the reactive Cys283 of rabbit muscle creatine kinasedipyridyl-dithio substrate to evaluate the protein disulfide-thiol interchange activity of the auxin stimulated NADH: protein disulfide reductase (NADH oxidase) of soybean plasma membraneswater-soluble reagent in a study for introducing, in buffered saline, a reactive sulfhydryl group on water-soluble molecules bearing an alkyl-amino groupchromogen for sulfhydryl groups in the Ellman method for cholinesterase determinationsspectrophotometric determination of thiols and of total glutathione in human blood
Anbieter44 Anbieter
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Aladdin Scientific[email protected]
Syntechem Co.,Ltd[email protected]
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