(E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]phenyl]prop-2-enoic acid

Base Information

• Chemical Name: (E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]phenyl]prop-2-enoic acid
• CAS No.: 126959-78-2
• Molecular Formula: C21H18 N2 O4
• Molecular Weight: 0
• Mol file: 126959-78-2.mol

Synonyms:4-(beta-(7-dimethylamino-1,4-benzoxazin-2-one-3-yl)vinyl)phenylpropenoic acid

Chemical Property of (E)-3-[4-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]phenyl]prop-2-enoic acid

Chemical Property:

• Vapor Pressure: 1.22E-15mmHg at 25°C
• Boiling Point: 608.1°Cat760mmHg
• Flash Point: 321.5°C
• PSA: 83.64000
• Density: 1.21g/cm³
• LogP: 3.52220
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 362.12665706
• Heavy Atom Count: 27
• Complexity: 645

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC2=C(C=C1)N=C(C(=O)O2)C=CC3=CC=C(C=C3)C=CC(=O)O
• Isomeric SMILES: CN(C)C1=CC2=C(C=C1)N=C(C(=O)O2)/C=C/C3=CC=C(C=C3)/C=C/C(=O)O

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