Home Halogens 2-Thiopheneacetic acid, 5-(2-chloroacetyl)-

2-Thiopheneacetic acid, 5-(2-chloroacetyl)-

CAS No.:
175203-15-3
Catalog Number:
AG0020IO
Molecular Formula:
C8H7ClO3S
Molecular Weight:
218.6574
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Product Description
Catalog Number:
AG0020IO
Chemical Name:
2-Thiopheneacetic acid, 5-(2-chloroacetyl)-
CAS Number:
175203-15-3
Molecular Formula:
C8H7ClO3S
Molecular Weight:
218.6574
MDL Number:
MFCD00068027
IUPAC Name:
2-[5-(2-chloroacetyl)thiophen-2-yl]acetic acid
InChI:
InChI=1S/C8H7ClO3S/c9-4-6(10)7-2-1-5(13-7)3-8(11)12/h1-2H,3-4H2,(H,11,12)
InChI Key:
ZNLXEDDUXFMEML-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccc(s1)CC(=O)O
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.98g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.651g/mol
Monoisotopic Mass:
217.98g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties