Home Halogens 5-bromo-4-methylfuran-2-carbaldehyde

5-bromo-4-methylfuran-2-carbaldehyde

CAS No.:
1368361-17-4
Catalog Number:
AG01DVY0
Molecular Formula:
C6H5BrO2
Molecular Weight:
189.0067
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Product Description
Catalog Number:
AG01DVY0
Chemical Name:
5-bromo-4-methylfuran-2-carbaldehyde
CAS Number:
1368361-17-4
Molecular Formula:
C6H5BrO2
Molecular Weight:
189.0067
MDL Number:
MFCD22062895
IUPAC Name:
5-bromo-4-methylfuran-2-carbaldehyde
InChI:
InChI=1S/C6H5BrO2/c1-4-2-5(3-8)9-6(4)7/h2-3H,1H3
InChI Key:
MRBPTPZVRAXMAR-UHFFFAOYSA-N
SMILES:
O=Cc1cc(c(o1)Br)C
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.947g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.008g/mol
Monoisotopic Mass:
187.947g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties