Procodazole
Grundinformationen
- CAS
23249-97-0- Standard-SMILES
O=C(O)CCc1nc2ccccc2[nH]1- InChIKey
XYWJNTOURDMTPI-UHFFFAOYSA-N- Summenformel
- C10H10N2O2
- Durchschnittliche Molmasse
- 190,2 g/mol
- Monoisotopische Masse
- 190,07422757
Namen und Bezeichner
- Bevorzugter Name
- Procodazole
- IUPAC
- 3-(1H-benzimidazol-2-yl)propanoic acid
- Englischer Name
- 2-Benzimidazolepropionic acid
- Summenformel
- C10H10N2O2
- Molmasse
- 190.2
Namen und Synonyme
Procodazole23249-97-02-Benzimidazolepropionic acid1H-Benzimidazole-2-propanoic acidProcodazolPropazolEstimulocelProcodazole [INN]Procodazolum2-(2-Carboxyethyl)benzimidazoleProcodazol [INN-Spanish]Procodazolum [INN-Latin]
Weitere Namen anzeigen
3-(1H-propazoleAKOS AUF2065IFLAB-BB F0852-0156
NSC 35790NSC-35790DTXSID5045093UNII-SG5IU7FD3RSG5IU7FD3Rbeta-(2-Benzimidazole)propionic acidbeta-(2-Benzimidazolyl)propionic acidAL-1241
Datenbank-Bezeichner
- CAS
23249-97-0- PubChem CID
- 65708
- DTXSID
DTXSID5045093- ChEMBL
CHEMBL596009- ChEBI
CHEBI:134840- UNII
- SG5IU7FD3R
- EC Number
- 628-218-7
- Nikkaji
- J16.767C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,1
- Polarare Oberfläche (TPSA)
- 66 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 220
Physikochemische Eigenschaften
- Schmelzpunkt
- 229 · 229-231 °C (dec.)(lit.)
- Siedepunkt
- 497.9 · 497.9±28.0 °C(Predicted)
- Dichte
- 1.367 · 1.367±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- Löslichkeit
- 30 mg/mL · DMSO : ≥ 30 mg/mL (157.73 mM)
- Aggregatzustand
- Solid
- pka
- 3.98 · 3.98±0.10(Predicted)
- Farbe
- White to off-white
- Merck
- 13 · 13,7851
- InChI
- InChI=1S/C10H10N2O2/c13-10(14)6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6H2,(H,11,12)(H,13,14)
- InChIKey
- XYWJNTOURDMTPI-UHFFFAOYSA-N
- SMILES
- C1(CCC(O)=O)NC2=CC=CC=C2N=1
- CAS Datenbank
- 23249 · 23249-97-0(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 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (97.5%): 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, P317, 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 40 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.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (97.5%)；Eye Irrit. 2 (97.5%)；Acute Tox. 4 (100%)；STOT SE 3 (97.5%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29332990
- RTECS-Nr.
- UE7480000
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xn,Xi
- safety_code
Chemie und Industrie
Anwendungen
Verwenden2-Benzimidazolepropionic acid is suitable reagent for use in the method of generation of monoclonal antibodies against very small drug hapten, 5-benzimidazolecarboxylic acid by in vivo immunisation method and an in vitro immunisation procedure. It may be used in the synthesis of cytidine derivatives.
Vor- und nachgelagerte Produkte
Nachgelagerte Produkte
Anbieter68 Anbieter
韶远科技(上海)有限公司4000665055 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
南京翔睿科技有限公司021-021-00000000 15715199582
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]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Nantong HI-FUTURE Biology Co., Ltd.+86-18051384581 · [email protected]
苏州维塔力生物医药有限公司
Zugehörige Reaktionen
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Notizen zur Verbindung
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