Home Halogens 2-[4-(4-bromobenzamido)phenyl]acetic acid

2-[4-(4-bromobenzamido)phenyl]acetic acid

CAS No.:
953737-25-2
Catalog Number:
AG019V6B
Molecular Formula:
C15H12BrNO3
Molecular Weight:
334.1647
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Product Description
Catalog Number:
AG019V6B
Chemical Name:
2-[4-(4-bromobenzamido)phenyl]acetic acid
CAS Number:
953737-25-2
Molecular Formula:
C15H12BrNO3
Molecular Weight:
334.1647
MDL Number:
MFCD09733620
IUPAC Name:
2-[4-[(4-bromobenzoyl)amino]phenyl]acetic acid
InChI:
InChI=1S/C15H12BrNO3/c16-12-5-3-11(4-6-12)15(20)17-13-7-1-10(2-8-13)9-14(18)19/h1-8H,9H2,(H,17,20)(H,18,19)
InChI Key:
MSLLBBVXVAPZKE-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Br)Nc1ccc(cc1)CC(=O)O
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
334.169g/mol
Monoisotopic Mass:
333g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties