Home Carboxes 1005584-90-6
1005584-90-6,MFCD04969136
Catalog No.:AA00028O
1005584-90-6 | Methyl 4-chloro-1H-pyrazole-3-carboxylate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$71.00   $50.00
- +
5g
98%
in stock  
$229.00   $160.00
- +
10g
98%
in stock  
$421.00   $295.00
- +
25g
98%
in stock  
$881.00   $617.00
- +
100g
98%
in stock  
$2,984.00   $2,089.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00028O
Chemical Name:
Methyl 4-chloro-1H-pyrazole-3-carboxylate
CAS Number:
1005584-90-6
Molecular Formula:
C5H5ClN2O2
Molecular Weight:
160.5584
MDL Number:
MFCD04969136
IUPAC Name:
methyl 4-chloro-1H-pyrazole-5-carboxylate
InChI:
InChI=1S/C5H5ClN2O2/c1-10-5(9)4-3(6)2-7-8-4/h2H,1H3,(H,7,8)
InChI Key:
AQUQWWCPNUDMIX-UHFFFAOYSA-N
SMILES:
COC(=O)c1n[nH]cc1Cl
Properties
Computed Properties
 
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.004g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.557g/mol
Monoisotopic Mass:
160.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Synonyms
 
methyl 4-chloro-1H-pyrazole-3-carboxylate 
1005584-90-6 
CTK6J1178 
KS-00003KIW 
DTXSID50428078 
AQUQWWCPNUDMIX-UHFFFAOYSA-N 
ALBB-012524 
ZINC4243785 
7193AC 
BBL016041 
MFCD14702903 
SBB021755 
methyl 4-chloro-1H-pyrazole-5-carboxylate 
STK312909 
AKOS000307869 
AKOS006346520 
FS-1834 
MCULE-8626864149 
AJ-49594 
AJ-49595 
AK125169 
AB0072789 
BB 0258772 
4-Chloro-2H-pyrazole-3-carboxylic acid methyl ester 
FT-0683605 
ST45092055 
Y-1509 
4-Chloro-1H-pyrazole-3-carboxylic acid methyl ester 
I14-28384 
4-CHLORO-1H-PYRAZOLE-3-CARBOXYLIC ACID METHYLESTER 
C5H5ClN2O2 
ZINC04243785 
CID7147513 
N/A 
1H-pyrazole-3-carboxylic acid, 4-chloro-, methyl ester 
4-Chloro-1 H -pyrazole-3-carboxylic acid methyl ester 
methyl 4-chloropyrazole-3-carboxylate 
AC1OGECG 
SCHEMBL983024 
SCHEMBL16427401 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A