Home Halogens 2-[1-(5-bromothiophen-2-yl)-N-methylformamido]acetic acid

2-[1-(5-bromothiophen-2-yl)-N-methylformamido]acetic acid

CAS No.:
1016705-13-7
Catalog Number:
AG019W23
Molecular Formula:
C8H8BrNO3S
Molecular Weight:
278.1230
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Product Description
Catalog Number:
AG019W23
Chemical Name:
2-[1-(5-bromothiophen-2-yl)-N-methylformamido]acetic acid
CAS Number:
1016705-13-7
Molecular Formula:
C8H8BrNO3S
Molecular Weight:
278.1230
MDL Number:
MFCD09814812
IUPAC Name:
2-[(5-bromothiophene-2-carbonyl)-methylamino]acetic acid
InChI:
InChI=1S/C8H8BrNO3S/c1-10(4-7(11)12)8(13)5-2-3-6(9)14-5/h2-3H,4H2,1H3,(H,11,12)
InChI Key:
RJFITWAKMVXQIU-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1ccc(s1)Br)CC(=O)O
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.941g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.12g/mol
Monoisotopic Mass:
276.941g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties