Home Halogens methyl (2E)-3-(5-bromofuran-2-yl)prop-2-enoate

methyl (2E)-3-(5-bromofuran-2-yl)prop-2-enoate

CAS No.:
62157-66-8
Catalog Number:
AG01E8MM
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
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Product Description
Catalog Number:
AG01E8MM
Chemical Name:
methyl (2E)-3-(5-bromofuran-2-yl)prop-2-enoate
CAS Number:
62157-66-8
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
MDL Number:
MFCD07799850
IUPAC Name:
methyl 3-(5-bromofuran-2-yl)prop-2-enoate
InChI:
InChI=1S/C8H7BrO3/c1-11-8(10)5-3-6-2-4-7(9)12-6/h2-5H,1H3
InChI Key:
HHPXRRQKAZDWDG-UHFFFAOYSA-N
SMILES:
COC(=O)/C=C/c1ccc(o1)Br
Properties
Complexity:
191  
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:
0
Isotope Atom Count:
0
Molecular Weight:
231.045g/mol
Monoisotopic Mass:
229.958g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.5  
Properties