Cyclobenzaprine Hydrochloride

Base Information

• Chemical Name: Cyclobenzaprine Hydrochloride
• CAS No.: 6202-23-9
• Molecular Formula: C20H21N.HCl
• Molecular Weight: 311.88
• Hs Code.: 29214990
• European Community (EC) Number: 228-264-4
• NSC Number: 758414,173379,169900,78206
• UNII: 0VE05JYS2P
• DSSTox Substance ID: DTXSID2045105
• Wikidata: Q27106282
• NCI Thesaurus Code: C47465
• RXCUI: 52101
• ChEMBL ID: CHEMBL1200636
• Mol file: 6202-23-9.mol

Synonyms:cyclobenzaprine;cyclobenzaprine hydrochloride;Flexeril;Lisseril

Chemical Property of Cyclobenzaprine Hydrochloride

Chemical Property:

• Appearance/Colour: Crystalline Solid
• Vapor Pressure: 8.45E-07mmHg at 25°C
• Melting Point: 216-218°C
• Boiling Point: 405.9 °C at 760 mmHg
• Flash Point: 177.8 °C
• PSA: 3.24000
• LogP: 5.35580
• Storage Temp.: -20°C Freezer
• Solubility.: ≥15.59 mg/mL in DMSO; ≥5.32 mg/mL in EtOH; ≥54.3 mg/mL in H2O
• Water Solubility.: Completely soluble in water
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 311.1440774
• Heavy Atom Count: 22
• Complexity: 365

Purity/Quality:

99% ^*data from raw suppliers

Cyclobenzaprine Hydrochloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,T,F
• Statements: 20/21/22-39/23/24/25-23/24/25-11
• Safety Statements: 36-45-36/37-16-7

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31.Cl
• Recent ClinicalTrials: Fixed-dose Combination of Etoricoxib + Cyclobenzaprine for Pain Relief After Third Molar Extraction in Brazil
• Description: Cyclobenzaprine is a skeletal muscle relaxant that also has sedative properties. It has been shown to antagonize muscarinic receptors (Kis = 25, 60, and 6 nM for M1, M2, and M3, respectively), serotonin 5-HT2 receptors (Kis = 56 and 330 nM for 5-HT2C and 5-HT2B, respectively), and histamine H1 receptor (IC50 = 20 nM).
• Uses: Cyclobenzaprine hydrochloride cam be used as muscle relaxant (skeletal). Cyclobenzaprine hydrochloride can be used as a serotonin receptor inhibitor. Cyclobenzaprine hydrochloride has been used to study its effect on the muscles of dystrophin-deficient mdx5Cv mice.
• Therapeutic Function: Muscle relaxant