Home Halogens 2-[1-(5-bromo-2-methylphenyl)-N-methylformamido]acetic acid

2-[1-(5-bromo-2-methylphenyl)-N-methylformamido]acetic acid

CAS No.:
1482137-44-9
Catalog Number:
AG01BBQP
Molecular Formula:
C11H12BrNO3
Molecular Weight:
286.1219
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Product Description
Catalog Number:
AG01BBQP
Chemical Name:
2-[1-(5-bromo-2-methylphenyl)-N-methylformamido]acetic acid
CAS Number:
1482137-44-9
Molecular Formula:
C11H12BrNO3
Molecular Weight:
286.1219
MDL Number:
MFCD21214993
IUPAC Name:
2-[(5-bromo-2-methylbenzoyl)-methylamino]acetic acid
InChI:
InChI=1S/C11H12BrNO3/c1-7-3-4-8(12)5-9(7)11(16)13(2)6-10(14)15/h3-5H,6H2,1-2H3,(H,14,15)
InChI Key:
NQKPNPSGHFJRBC-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1cc(Br)ccc1C)CC(=O)O
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
286.125g/mol
Monoisotopic Mass:
285g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties