Home Halogens 3-(3-bromothiophen-2-yl)propanoic acid

3-(3-bromothiophen-2-yl)propanoic acid

CAS No.:
1247800-38-9
Catalog Number:
AG01EL4F
Molecular Formula:
C7H7BrO2S
Molecular Weight:
235.0983
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Product Description
Catalog Number:
AG01EL4F
Chemical Name:
3-(3-bromothiophen-2-yl)propanoic acid
CAS Number:
1247800-38-9
Molecular Formula:
C7H7BrO2S
Molecular Weight:
235.0983
MDL Number:
MFCD16155293
IUPAC Name:
3-(3-bromothiophen-2-yl)propanoic acid
InChI:
InChI=1S/C7H7BrO2S/c8-5-3-4-11-6(5)1-2-7(9)10/h3-4H,1-2H2,(H,9,10)
InChI Key:
BKUHZTRYWRRUTA-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1sccc1Br
Properties
Complexity:
151  
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:
3  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties