Home Other Building Blocks 2-cyano-3-ethoxyprop-2-enoic acid

2-cyano-3-ethoxyprop-2-enoic acid

CAS No.:
114951-19-8
Catalog Number:
AG01A1KP
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A1KP
Chemical Name:
2-cyano-3-ethoxyprop-2-enoic acid
CAS Number:
114951-19-8
MDL Number:
MFCD08559022
IUPAC Name:
2-cyano-3-ethoxyprop-2-enoic acid
InChI:
InChI=1S/C6H7NO3/c1-2-10-4-5(3-7)6(8)9/h4H,2H2,1H3,(H,8,9)
InChI Key:
AVAQZFUVMGMHSC-UHFFFAOYSA-N
EC Number:
275-752-8
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.043g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.126g/mol
Monoisotopic Mass:
141.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
70.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.3  
Literature
Title Journal
Synthesis of some novel pyrazolo[3,4-d]pyrimidine derivatives as potential antimicrobial agents. Bioorganic & medicinal chemistry 20060315
Synthesis of novel 6-enaminopurines. Organic & biomolecular chemistry 20040821
Properties