2-amino-4-(4-ethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

Base Information

• Chemical Name: 2-amino-4-(4-ethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
• CAS No.: 5282-72-4
• Molecular Formula: C17H22 N2 O2 . Cl H
• Molecular Weight: 338.4003
• DSSTox Substance ID: DTXSID50385591
• Nikkaji Number: J3.557.868D
• Mol file: 5282-72-4.mol

Synonyms:2-amino-4-(4-ethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile;314767-26-5;5282-72-4;2-amino-4-(4-ethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile;Cambridge id 5282724;DTXSID50385591;DHFHPYAMOLEBRQ-UHFFFAOYSA-N;CCG-15785;MFCD00245015;STK041688;AKOS000487470;AKOS016340250;MS-6854;CS-0320412;UNM000000518701;J3.557.868D;AB00079083-01;AG-205/01834047;SR-01000408407;SR-01000408407-1;2-Amino-4-(4-ethoxy-phenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-;2-Amino-4-(4-ethoxyphenyl)-5-oxo-7,7-dimethyl-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile;2-AMINO-4-(4-ETHOXYPHENYL)-7,7-DIMETHYL-5-OXO-4,6,7,8-TETRAHYDRO2H-CHROMENE-3-CARBONITRILE

Chemical Property of 2-amino-4-(4-ethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

Chemical Property:

• Vapor Pressure: 6.8E-13mmHg at 25°C
• Boiling Point: 567.5°Cat760mmHg
• Flash Point: 297°C
• Density: 1.23g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 338.16304257
• Heavy Atom Count: 25
• Complexity: 672

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N