2,5-Dichlorothiophene-3-carboxylic acid
Grundinformationen
- CAS
36157-41-2- Standard-SMILES
O=C(O)c1cc(Cl)sc1Cl- InChIKey
FBUUZRITKBLZJX-UHFFFAOYSA-N- Summenformel
- C5H2Cl2O2S
- Durchschnittliche Molmasse
- 197,04 g/mol
- Monoisotopische Masse
- 195,9152559
Namen und Bezeichner
- Bevorzugter Name
- 2,5-Dichlorothiophene-3-carboxylic acid
- IUPAC
- 2,5-dichlorothiophene-3-carboxylic acid
- Englischer Name
- 2,5-Dichlorothiophene-3-carboxylic acid
- Summenformel
- C5H2Cl2O2S
- Molmasse
- 197.04
Namen und Synonyme
2,5-Dichlorothiophene-3-carboxylic acidDTXSID20279958RefChem:444355DTXCID20231112627-676-536157-41-22,5-Dichloro-3-thiophenecarboxylic acidMFCD000829082,5-Dichlorothiophene-3-carboxylicacid3-Thiophenecarboxylic acid, 2,5-dichloro-NSC14775CHEMBL4288645
Weitere Namen anzeigen
AKOS 90171RARECHEM AL BE 1205Rivaroxaban Impurity 772,5-DICHLORO-3-THIOPHENEFORMIC ACID3-Thiophenecarboxylicacid, 2,5-dichloro-2,5-Dichlorothiophene-3-carboxylic acid 97%2,5-DICHLOROTHIOPHENE-3-CARBOXYLIC ACID, 98+%2,5-DICHLOROTHIOPHENE-3-CARBOXYLIC ACID ISO 9001：2015 REACH
CS-W015685AM20090574F2182-0127FT-0610335SCHEMBL7925512,5-dichloro-3-thenoic acidSMSSF-0613824BDBM50467727
Datenbank-Bezeichner
- CAS
36157-41-2- PubChem CID
- 225438
- DTXSID
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,1
- Polarare Oberfläche (TPSA)
- 65,5 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 153
Physikochemische Eigenschaften
- Schmelzpunkt
- 147 · 147-151 °C(lit.)
- Siedepunkt
- 296.6 · 296.6±35.0 °C(Predicted)
- Dichte
- 1.708 · 1.708±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
- Aggregatzustand
- solid
- pka
- 3.36 · 3.36±0.30(Predicted)
- BRN
- 127865 · 127865
- InChI
- 1S/C5H2Cl2O2S/c6-3-1-2(5(8)9)4(7)10-3/h1H,(H,8,9)
- InChIKey
- FBUUZRITKBLZJX-UHFFFAOYSA-N
- SMILES
- OC(=O)c1cc(Cl)sc1Cl
- CAS Datenbank
- 36157 · 36157-41-2(CAS DataBase Reference)
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
H302 (91.1%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 5 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.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (91.1%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2934999090
- risk_code
- 22-36/37/38
- hazard_code
- Xn
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter85 Anbieter
苏州道澜生物医药科技有限公司15952404857 · [email protected]
天津始加生物医药科技有限公司15022261580 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.
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