Cloricromen hydrochloride

Base Information

• Chemical Name: Cloricromen hydrochloride
• CAS No.: 74697-28-2
• Molecular Formula: C20H26ClNO5.ClH
• Molecular Weight: 432.341
• European Community (EC) Number: 643-085-5
• UNII: 931696CA9T
• ChEMBL ID: CHEMBL2354840
• DSSTox Substance ID: DTXSID9046499
• Wikidata: Q27271540
• Mol file: 74697-28-2.mol

Synonyms:Cloricromen hydrochloride;74697-28-2;UNII-931696CA9T;931696CA9T;Cloricromen (hydrochloride);DTXSID9046499;Proendotel;DTXCID7026499;CAS-74697-28-2;NCGC00165769-02;Proendotel (TN);CLORICROMEN HCL;Cloricromen hydrohloride;SCHEMBL9220182;CHEMBL2354840;Tox21_112260;CLORICROMEN HYDROCHLORIDE [MI];Tox21_112260_1;Cloricromene, >=98% (HPLC), solid;HY-116678A;NCGC00165769-03;CLORICROMEN HYDROCHLORIDE [WHO-DD];CS-0635551;D07736;Q27271540;((8-CHLORO-3-(2-(DIETHYLAMINO)ETHYL)-4-METHYL-2-OXO-2H-1-BENZOPYRAN-7-YL)OXY)ACETIC ACID ETHYL ESTER HYDROCHLORIDE

Chemical Property of Cloricromen hydrochloride

Chemical Property:

• Vapor Pressure: 6.45E-12mmHg at 25°C
• Melting Point: 221-222.3 °C
• Boiling Point: 538°C at 760 mmHg
• Flash Point: 279.2°C
• PSA: 68.98000
• LogP: 4.38300
• Storage Temp.: 2-8°C
• Solubility.: DMSO: soluble17mg/mL
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 431.1266283
• Heavy Atom Count: 28
• Complexity: 561

Purity/Quality:

98% ^*data from raw suppliers

Cloricromene ≥98% (HPLC), solid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCC1=C(C2=C(C(=C(C=C2)OCC(=O)OCC)Cl)OC1=O)C.Cl