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Home Carbonyls 3-(ethoxycarbonyl)but-3-enoic acid

3-(ethoxycarbonyl)but-3-enoic acid

CAS No.:
3377-29-5
Catalog Number:
AG01BEQ0
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
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Product Description
Catalog Number:
AG01BEQ0
Chemical Name:
3-(ethoxycarbonyl)but-3-enoic acid
CAS Number:
3377-29-5
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
MDL Number:
MFCD20542802
IUPAC Name:
3-ethoxycarbonylbut-3-enoic acid
InChI:
InChI=1S/C7H10O4/c1-3-11-7(10)5(2)4-6(8)9/h2-4H2,1H3,(H,8,9)
InChI Key:
IZUVGRMMRWJVKU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=C)CC(=O)O
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.058g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.153g/mol
Monoisotopic Mass:
158.058g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
Swelling properties of copolymeric hydrogels of poly(ethylene glycol) monomethacrylate and monoesters of itaconic acid for use in drug delivery. Journal of biomedical materials research. Part B, Applied biomaterials 20091101
Properties