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101012-12-8,MFCD02187331
Catalog No.:AA0003GS
101012-12-8 | 2-Chloro-1,3-thiazole-5-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$36.00   $25.00
- +
5g
95%
in stock  
$107.00   $75.00
- +
100g
96%
in stock  
$1,905.00   $1,334.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0003GS
Chemical Name:
2-Chloro-1,3-thiazole-5-carboxylic acid
CAS Number:
101012-12-8
Molecular Formula:
C4H2ClNO2S
Molecular Weight:
163.5822
MDL Number:
MFCD02187331
IUPAC Name:
2-chloro-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C4H2ClNO2S/c5-4-6-1-2(9-4)3(7)8/h1H,(H,7,8)
InChI Key:
HNJOKQPEJIWTRF-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(s1)Cl
Properties
Computed Properties
 
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.949g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.575g/mol
Monoisotopic Mass:
162.949g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
2-chloro-1,3-thiazole-5-carboxylic Acid 
101012-12-8 
CHEMBL2228305 
CTK0H3773 
KS-00001YPV 
DTXSID20363225 
2-chlorothiazol-5-carboxylic acid 
HNJOKQPEJIWTRF-UHFFFAOYSA-N 
2-Chloro-5-carboxy-1,3-thiazole 
5-Thiazolecarboxylicacid,2-chloro- 
CS-B1388 
ZINC1394516 
2-chlorothiazole-5-carboxylic acid 
2-chloro-thiazole-5-carboxylic acid 
ANW-46817 
SBB053137 
AKOS005070906 
MCULE-4005312484 
QC-6403 
RP02322 
RTR-000291 
SB13411 
AJ-25560 
2-Chloro-5-thiazolecarboxylic acid 
AK-45674 
BP-10190 
SC-35119 
AB0034393 
DB-000701 
ST2416654 
TR-000291 
FT-0680516 
X8541 
C-1404 
5-Thiazolecarboxylic acid, 2-chloro- 
C80004 
90282-EP2284169A1 
90282-EP2287161A1 
90282-EP2287162A1 
90282-EP2301929A1 
90282-EP2301935A1 
90282-EP2305674A1 
6R-0067 
I09-0989 
W-204394 
5-Thiazolecarboxylicacid, 2-chloro- 
2-Chloro-1,3-thiazole-5-carboxylic acid, AldrichCPR 
C4H2ClNO2S 
2-Chlorothiazole-5-Carboxylicacid 
ACN-039191 
CID1481389 
2-CHLORO-1,3-THIAZOLE-5-CARBOXYLICACID 
2-chlorothiazole-5-carboxylic acid, 95% - 1G 1g 
2-(4-TRIFLUOROMETHYLPHENYL)THIAZOLE-5-CARBALDEHYDE 
MFCD02187331 
ACMC-1BRCY 
AC1LS2OE 
SCHEMBL293931 
Literature

Title: Neonicotinoid insecticides: oxidative stress in planta and metallo-oxidase inhibition.

Journal: Journal of agricultural and food chemistry 20110511

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