Ethyl 5-[3-(dimethylamino)prop-1-ynyl]nicotinate

Base Information

• Chemical Name: Ethyl 5-[3-(dimethylamino)prop-1-ynyl]nicotinate
• CAS No.: 175203-71-1
• Molecular Formula: C13H16 N2 O2
• Molecular Weight: 232.28
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID00381341
• Wikidata: Q82172117
• Mol file: 175203-71-1.mol

Synonyms:175203-71-1;ethyl 5-[3-(dimethylamino)prop-1-ynyl]nicotinate;ethyl 5-[3-(dimethylamino)prop-1-ynyl]pyridine-3-carboxylate;ethyl 5-[3-(dimethylamino)prop-1-yn-1-yl]pyridine-3-carboxylate;3-Pyridinecarboxylic acid, 5-[3-(dimethylamino)-1-propyn-1-yl]-, ethyl ester;ethyl 5-(3-(dimethylamino)prop-1-ynyl)nicotinate;SCHEMBL14156001;DTXSID00381341;MFCD00178751;AKOS015908613;FT-0626114;Ethyl 5-(3-(dimethylamino)prop-1-yn-1-yl)nicotinate;3-Pyridinecarboxylicacid,5-[3-(dimethylamino)-1-propyn-1-yl]-,ethyl ester

Chemical Property of Ethyl 5-[3-(dimethylamino)prop-1-ynyl]nicotinate

Chemical Property:

• Vapor Pressure: 7.04E-05mmHg at 25°C
• Boiling Point: 343.4°Cat760mmHg
• Flash Point: 161.5°C
• PSA: 42.43000
• Density: 1.12g/cm³
• LogP: 1.17140
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 232.121177757
• Heavy Atom Count: 17
• Complexity: 314

Purity/Quality:

98%min ^*data from raw suppliers

ETHYL 5-[3-(DIMETHYLAMINO)PROP-1-YNYL]NICOTINATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:
• Hazard Codes: R36/37/38:
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CN=CC(=C1)C#CCN(C)C