Home Halogens 2-[(5-bromothiophen-2-yl)formamido]propanoic acid

2-[(5-bromothiophen-2-yl)formamido]propanoic acid

CAS No.:
1396964-88-7
Catalog Number:
AG019VX1
Molecular Formula:
C8H8BrNO3S
Molecular Weight:
278.1230
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Product Description
Catalog Number:
AG019VX1
Chemical Name:
2-[(5-bromothiophen-2-yl)formamido]propanoic acid
CAS Number:
1396964-88-7
Molecular Formula:
C8H8BrNO3S
Molecular Weight:
278.1230
MDL Number:
MFCD09813763
IUPAC Name:
2-[(5-bromothiophene-2-carbonyl)amino]propanoic acid
InChI:
InChI=1S/C8H8BrNO3S/c1-4(8(12)13)10-7(11)5-2-3-6(9)14-5/h2-4H,1H3,(H,10,11)(H,12,13)
InChI Key:
ZSHFYFLYCTVRFH-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)NC(=O)c1ccc(s1)Br
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:
2  
Isotope Atom Count:
0
Molecular Weight:
278.12g/mol
Monoisotopic Mass:
276.941g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties