Home Halogens 2-[4-(5-bromofuran-2-amido)phenyl]acetic acid

2-[4-(5-bromofuran-2-amido)phenyl]acetic acid

CAS No.:
692290-41-8
Catalog Number:
AG019V5D
Molecular Formula:
C13H10BrNO4
Molecular Weight:
324.1268
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Product Description
Catalog Number:
AG019V5D
Chemical Name:
2-[4-(5-bromofuran-2-amido)phenyl]acetic acid
CAS Number:
692290-41-8
Molecular Formula:
C13H10BrNO4
Molecular Weight:
324.1268
MDL Number:
MFCD03723335
IUPAC Name:
2-[4-[(5-bromofuran-2-carbonyl)amino]phenyl]acetic acid
InChI:
InChI=1S/C13H10BrNO4/c14-11-6-5-10(19-11)13(18)15-9-3-1-8(2-4-9)7-12(16)17/h1-6H,7H2,(H,15,18)(H,16,17)
InChI Key:
GQNZKOPOHUCJOB-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1)NC(=O)c1ccc(o1)Br
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.979g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
324.13g/mol
Monoisotopic Mass:
322.979g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties