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10242-10-1,MFCD00060512
Catalog No.:AA0007CO
10242-10-1 | 5-Chlorobenzofuran-2-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$36.00   $25.00
- +
5g
96%
in stock  
$143.00   $100.00
- +
10g
96%
in stock  
$258.00   $180.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0007CO
Chemical Name:
5-Chlorobenzofuran-2-carboxylic acid
CAS Number:
10242-10-1
Molecular Formula:
C9H5ClO3
Molecular Weight:
196.5872
MDL Number:
MFCD00060512
IUPAC Name:
5-chloro-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C9H5ClO3/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4H,(H,11,12)
InChI Key:
JETRXAHRPACNMA-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)cc(o2)C(=O)O
Properties
Computed Properties
 
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.993g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.586g/mol
Monoisotopic Mass:
195.993g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
5-Chlorobenzofuran-2-carboxylic acid 
10242-10-1 
4-Fluoroquinolin-2-amine 
ACMC-20am44 
AC1Q73UL 
SCHEMBL705754 
CHEMBL412667 
CTK0I1814 
KS-00001CIX 
DTXSID40359089 
JETRXAHRPACNMA-UHFFFAOYSA-N 
HMS1698D07 
5-chloro-1-benzofuran-2-carboxylic acid 
ZINC532501 
BBL009658 
SBB077383 
STK899493 
5-chlo-robenzofuran-2-carboxylic acid 
AKOS000276153 
5-Chlorobenzo[b]furan-2carboxylic Acid 
AS06454 
CM10766 
CS-W010579 
5-chlorobenzo[b]furan-2-carboxylic acid 
FS-1523 
MB00499 
MCULE-1017602062 
RP25467 
VZ30252 
2-CARBOXY-5-CHLOROBENZO[B]FURAN 
5-Chlorobenzo[b]furan-2 carboxylic Acid 
AK305294 
BAS 12719327 
AB0073415 
5-Chloro-benzofuran-2-carboxylic acid 
TR-000607 
5-CHLORO-2-BENZOFURANCARBOXYLIC ACID 
FT-0636662 
ST50293863 
Z5432 
C-5520 
5-chlorobenzofuran-2-carboxylic acid, AldrichCPR 
J-517380 
I14-16610 
Z104341200 
2-BENZOFURANCARBOXYLIC ACID, 5-CHLORO- 
C9H5ClO3 
AIDS209140 
CID937838 
C2890 
5-Chlorobenzofuran-2-carboxylic acid, 97% - 1G 1g 
MFCD00060512 
2-Benzofurancarboxylicacid, 5-chloro- 
5-Chlorocoumarilic Acid 
AC1LITF6 
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening.

Journal: Journal of medicinal chemistry 20040506

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