Home Fluorides 1000339-98-9
1000339-98-9,MFCD09263211
Catalog No.:AA0000AJ
1H-Indazole, 4-(trifluoromethyl)- | 1000339-98-9
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250mg
1 week  
$169.00
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1g
1 week  
$262.00
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000AJ
Chemical Name:
1H-Indazole, 4-(trifluoromethyl)-
CAS Number:
1000339-98-9
Molecular Formula:
C8H5F3N2
Molecular Weight:
186.1339
MDL Number:
MFCD09263211
IUPAC Name:
4-(trifluoromethyl)-1H-indazole
InChI:
InChI=1S/C8H5F3N2/c9-8(10,11)6-2-1-3-7-5(6)4-12-13-7/h1-4H,(H,12,13)
InChI Key:
KCWIWQGNCLKDJZ-UHFFFAOYSA-N
SMILES:
FC(c1cccc2c1cn[nH]2)(F)F
Properties
Computed Properties
 
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.137g/mol
Monoisotopic Mass:
186.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
4-(Trifluoromethyl)-1H-indazole 
1000339-98-9 
ZX-AP010735 
1H-Indazole, 4-(trifluoromethyl)- 
ANW-70427 
BBL102938 
CT-194 
FCH922947 
MFCD09263211 
PC8056 
SBB056404 
STL556747 
4-trifluoromethyl-1h-indazole 
ZINC14985959 
AKOS006344552 
MB07219 
RP03433 
AJ-66480 
AK100232 
TS-02592 
AB0039303 
AX8241202 
DB-058214 
J-650212 
TC-159172 
FT-0724074 
ST24023253 
Y6749 
Q-8474 
I10-1778 
J-513906 
C8H5F3N2 
W-204320 
SCHEMBL12683720 
SCHEMBL20188969 
CTK7B6864 
KS-00003TBS 
DTXSID80646703 
Literature
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