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20689-52-5

20689-52-5 | 2-Furancarboxylic acid, 5-bromo-, ethenyl ester

CAS No: 20689-52-5 Catalog No: AG002IQW MDL No:

Product Description

Catalog Number:
AG002IQW
Chemical Name:
2-Furancarboxylic acid, 5-bromo-, ethenyl ester
CAS Number:
20689-52-5
Molecular Formula:
C7H5BrO3
Molecular Weight:
217.0168
IUPAC Name:
ethenyl 5-bromofuran-2-carboxylate
InChI:
InChI=1S/C7H5BrO3/c1-2-10-7(9)5-3-4-6(8)11-5/h2-4H,1H2
InChI Key:
WVBWQMONOBHJRX-UHFFFAOYSA-N
SMILES:
Brc1ccc(o1)C(=O)OC=C

Properties

Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.942g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.018g/mol
Monoisotopic Mass:
215.942g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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