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1015845-71-2,MFCD08691760
Catalog No.:AA0004SM
1015845-71-2 | 4-Chloro-6-(4-methyl-1h-pyrazol-1-yl)pyrimidine
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1g
95%
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$118.00   $83.00
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Technical Information
Catalog Number:
AA0004SM
Chemical Name:
4-Chloro-6-(4-methyl-1h-pyrazol-1-yl)pyrimidine
CAS Number:
1015845-71-2
Molecular Formula:
C8H7ClN4
Molecular Weight:
194.6210
MDL Number:
MFCD08691760
IUPAC Name:
4-chloro-6-(4-methylpyrazol-1-yl)pyrimidine
InChI:
InChI=1S/C8H7ClN4/c1-6-3-12-13(4-6)8-2-7(9)10-5-11-8/h2-5H,1H3
InChI Key:
FMSZLROESHSQPC-UHFFFAOYSA-N
SMILES:
Cc1cnn(c1)c1ncnc(c1)Cl
Properties
Computed Properties
 
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.036g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.622g/mol
Monoisotopic Mass:
194.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
1015845-71-2 
4-CHLORO-6-(4-METHYL-1H-PYRAZOL-1-YL)PYRIMIDINE 
AKOS010531086 
AB48377 
AJ-72248 
AM807371 
DA-19151 
CS-0061355 
FT-0730437 
ST24043600 
Y-4420 
Pyrimidine, 4-chloro-6-(4-methyl-1H-pyrazol-1-yl)- 
4-chloro-6-(4-methylpyrazol-1-yl)pyrimidine 
4-Chloro-6-(4-methyl-1H-pyrazol-1-yl)pyrimidine, AldrichCPR 
C8H7ClN4 
ACN-052903 
4-CHLORO-6-(4-METHYL-PYRAZOL-1-YL)-PYRIMIDINE 
CTK3J9934 
DTXSID70651068 
KS-00000R8W 
0415AA 
MFCD08691760 
ZINC19093864 
Literature
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