N-[2-(3,4-dimethoxyphenyl)ethyl]cycloheptanamine

Base Information

• Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]cycloheptanamine
• CAS No.: 353772-45-9
• Molecular Formula: C17H27NO2
• Molecular Weight: 277.4
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID40356694
• Wikidata: Q82136221
• Mol file: 353772-45-9.mol

Synonyms:N-[2-(3,4-dimethoxyphenyl)ethyl]cycloheptanamine;353772-45-9;Oprea1_038567;Oprea1_547683;DTXSID40356694;AKOS000232028;N-(3,4-Dimethoxyphenethyl)cycloheptanamine

Chemical Property of N-[2-(3,4-dimethoxyphenyl)ethyl]cycloheptanamine

Chemical Property:

• Vapor Pressure: 1.6E-06mmHg at 25°C
• Boiling Point: 397.3°C at 760 mmHg
• PKA: 10.56±0.20(Predicted)
• Flash Point: 170.8°C
• PSA: 30.49000
• Density: 1.02g/cm³
• LogP: 3.94960
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 277.204179104
• Heavy Atom Count: 20
• Complexity: 251

Purity/Quality:

N-[2-(3,4-DIMETHOXYPHENYL)ETHYL]CYCLOHEPTANAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)CCNC2CCCCCC2)OC