Home Halogens 3-(5-bromofuran-2-yl)-2-methylprop-2-enoic acid

3-(5-bromofuran-2-yl)-2-methylprop-2-enoic acid

CAS No.:
773112-39-3
Catalog Number:
AG01BRQ4
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
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Product Description
Catalog Number:
AG01BRQ4
Chemical Name:
3-(5-bromofuran-2-yl)-2-methylprop-2-enoic acid
CAS Number:
773112-39-3
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
MDL Number:
MFCD06207358
IUPAC Name:
3-(5-bromofuran-2-yl)-2-methylprop-2-enoic acid
InChI:
InChI=1S/C8H7BrO3/c1-5(8(10)11)4-6-2-3-7(9)12-6/h2-4H,1H3,(H,10,11)
InChI Key:
ZGINPILGQVOXTL-UHFFFAOYSA-N
SMILES:
CC(=Cc1ccc(o1)Br)C(=O)O
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.958g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.045g/mol
Monoisotopic Mass:
229.958g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.4  
Properties