Home Halogens 2-(3-bromo-5-methylthiophen-2-yl)acetic acid

2-(3-bromo-5-methylthiophen-2-yl)acetic acid

CAS No.:
1484993-84-1
Catalog Number:
AG01BU01
Molecular Formula:
C7H7BrO2S
Molecular Weight:
235.0983
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Product Description
Catalog Number:
AG01BU01
Chemical Name:
2-(3-bromo-5-methylthiophen-2-yl)acetic acid
CAS Number:
1484993-84-1
Molecular Formula:
C7H7BrO2S
Molecular Weight:
235.0983
MDL Number:
MFCD21192719
IUPAC Name:
2-(3-bromo-5-methylthiophen-2-yl)acetic acid
InChI:
InChI=1S/C7H7BrO2S/c1-4-2-5(8)6(11-4)3-7(9)10/h2H,3H2,1H3,(H,9,10)
InChI Key:
VWMYXKBJBYBCOA-UHFFFAOYSA-N
SMILES:
Cc1cc(c(s1)CC(=O)O)Br
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties