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90922-85-3

90922-85-3 | 3-Ethoxy-4-hydroxyphenylnitroethene

CAS No: 90922-85-3 Catalog No: AG01E9I5 MDL No:

Product Description

Catalog Number:
AG01E9I5
Chemical Name:
3-Ethoxy-4-hydroxyphenylnitroethene
CAS Number:
90922-85-3
IUPAC Name:
2-ethoxy-4-[(E)-2-nitroethenyl]phenol
InChI:
InChI=1S/C10H11NO4/c1-2-15-10-7-8(3-4-9(10)12)5-6-11(13)14/h3-7,12H,2H2,1H3/b6-5+
InChI Key:
GAJIQLKTZKVZAJ-AATRIKPKSA-N
NSC Number:
122821

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Literature

Title Journal
The synthesis and biologic evaluation of anti-platelet and cytotoxic β-nitrostyrenes. Bioorganic & medicinal chemistry 20101101

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