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1015846-56-6,MFCD09971279
Catalog No.:AA0004U2
1015846-56-6 | 4-Chloro-1-methyl-1h-indazole-3-carbonitrile
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$74.00   $52.00
- +
5g
95%
in stock  
$212.00   $148.00
- +
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Technical Information
Catalog Number:
AA0004U2
Chemical Name:
4-Chloro-1-methyl-1h-indazole-3-carbonitrile
CAS Number:
1015846-56-6
Molecular Formula:
C9H6ClN3
Molecular Weight:
191.6170
MDL Number:
MFCD09971279
IUPAC Name:
4-chloro-1-methylindazole-3-carbonitrile
InChI:
InChI=1S/C9H6ClN3/c1-13-8-4-2-3-6(10)9(8)7(5-11)12-13/h2-4H,1H3
InChI Key:
WDDAWSGEOSMNFS-UHFFFAOYSA-N
SMILES:
N#Cc1nn(c2c1c(Cl)ccc2)C
Properties
Computed Properties
 
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.025g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.618g/mol
Monoisotopic Mass:
191.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
4-CHLORO-1-METHYL-1H-INDAZOLE-3-CARBONITRILE 
1015846-56-6 
MCULE-8732568335 
AJ-71858 
Y-6183 
1H-Indazole-3-carbonitrile, 4-chloro-1-methyl- 
SCHEMBL17984817 
CTK3J9981 
DTXSID20650985 
ZX-CM006212 
FCH878917 
MFCD09971279 
ZINC19092619 
AKOS006312275 
Literature
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