Home Halogens 4-(2,5-dichlorothiophen-3-yl)butanoic acid

4-(2,5-dichlorothiophen-3-yl)butanoic acid

CAS No.:
34967-65-2
Catalog Number:
AG019Z29
Molecular Formula:
C8H8Cl2O2S
Molecular Weight:
239.1189
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Product Description
Catalog Number:
AG019Z29
Chemical Name:
4-(2,5-dichlorothiophen-3-yl)butanoic acid
CAS Number:
34967-65-2
Molecular Formula:
C8H8Cl2O2S
Molecular Weight:
239.1189
MDL Number:
MFCD11642200
IUPAC Name:
4-(2,5-dichlorothiophen-3-yl)butanoic acid
InChI:
InChI=1S/C8H8Cl2O2S/c9-6-4-5(8(10)13-6)2-1-3-7(11)12/h4H,1-3H2,(H,11,12)
InChI Key:
YVWAQSHXWYMXCF-UHFFFAOYSA-N
SMILES:
OC(=O)CCCc1cc(sc1Cl)Cl
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.962g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.11g/mol
Monoisotopic Mass:
237.962g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties