Home Halogens 2-Furancarboxylic acid, 5-[(4-bromophenoxy)methyl]-

2-Furancarboxylic acid, 5-[(4-bromophenoxy)methyl]-

CAS No.:
74556-58-4
Catalog Number:
AG00ICJA
Molecular Formula:
C12H9BrO4
Molecular Weight:
297.1015
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Product Description
Catalog Number:
AG00ICJA
Chemical Name:
2-Furancarboxylic acid, 5-[(4-bromophenoxy)methyl]-
CAS Number:
74556-58-4
Molecular Formula:
C12H9BrO4
Molecular Weight:
297.1015
MDL Number:
MFCD03074462
IUPAC Name:
5-[(4-bromophenoxy)methyl]furan-2-carboxylic acid
InChI:
InChI=1S/C12H9BrO4/c13-8-1-3-9(4-2-8)16-7-10-5-6-11(17-10)12(14)15/h1-6H,7H2,(H,14,15)
InChI Key:
OPOBLZKJGHHTAA-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)OCc1ccc(o1)C(=O)O
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.968g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
297.104g/mol
Monoisotopic Mass:
295.968g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties