Home Halogens 2-(5-bromothiophen-2-yl)propanoic acid

2-(5-bromothiophen-2-yl)propanoic acid

CAS No.:
139547-22-1
Catalog Number:
AG019STO
Molecular Formula:
C7H7BrO2S
Molecular Weight:
235.0983
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Product Description
Catalog Number:
AG019STO
Chemical Name:
2-(5-bromothiophen-2-yl)propanoic acid
CAS Number:
139547-22-1
Molecular Formula:
C7H7BrO2S
Molecular Weight:
235.0983
MDL Number:
MFCD14530844
IUPAC Name:
2-(5-bromothiophen-2-yl)propanoic acid
InChI:
InChI=1S/C7H7BrO2S/c1-4(7(9)10)5-2-3-6(8)11-5/h2-4H,1H3,(H,9,10)
InChI Key:
MFVPTFUXSSLCTE-UHFFFAOYSA-N
SMILES:
CC(c1ccc(s1)Br)C(=O)O
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.935g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.095g/mol
Monoisotopic Mass:
233.935g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties