Home Halogens 2-(3-bromobenzamido)-4-fluorobenzoic acid

2-(3-bromobenzamido)-4-fluorobenzoic acid

CAS No.:
1017020-32-4
Catalog Number:
AG019NA7
Molecular Formula:
C14H9BrFNO3
Molecular Weight:
338.1286
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Product Description
Catalog Number:
AG019NA7
Chemical Name:
2-(3-bromobenzamido)-4-fluorobenzoic acid
CAS Number:
1017020-32-4
Molecular Formula:
C14H9BrFNO3
Molecular Weight:
338.1286
MDL Number:
MFCD09938931
IUPAC Name:
2-[(3-bromobenzoyl)amino]-4-fluorobenzoic acid
InChI:
InChI=1S/C14H9BrFNO3/c15-9-3-1-2-8(6-9)13(18)17-12-7-10(16)4-5-11(12)14(19)20/h1-7H,(H,17,18)(H,19,20)
InChI Key:
LAHBDMGRJXRMBR-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)NC(=O)c1cccc(c1)Br)C(=O)O
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.975g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
338.132g/mol
Monoisotopic Mass:
336.975g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties