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Home Halogens 2-Thiophenecarboxamide, 3-chloro-

2-Thiophenecarboxamide, 3-chloro-

CAS No.:
147123-68-0
Catalog Number:
AG001EMU
Molecular Formula:
C5H4ClNOS
Molecular Weight:
161.6094
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$80
- +
5g
97%
1 week
United States
$163
- +
25g
97%
1 week
United States
$469
- +
Product Description
Catalog Number:
AG001EMU
Chemical Name:
2-Thiophenecarboxamide, 3-chloro-
CAS Number:
147123-68-0
Molecular Formula:
C5H4ClNOS
Molecular Weight:
161.6094
MDL Number:
MFCD00068144
IUPAC Name:
3-chlorothiophene-2-carboxamide
InChI:
InChI=1S/C5H4ClNOS/c6-3-1-2-9-4(3)5(7)8/h1-2H,(H2,7,8)
InChI Key:
PUKKVMZZENXNSR-UHFFFAOYSA-N
SMILES:
NC(=O)c1sccc1Cl
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.97g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
161.603g/mol
Monoisotopic Mass:
160.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
In vitro metabolism of rivaroxaban, an oral, direct factor Xa inhibitor, in liver microsomes and hepatocytes of rats, dogs, and humans. Drug metabolism and disposition: the biological fate of chemicals 20090501
Properties