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912906-94-6,MFCD08548459
Catalog No.:AA01AR3D
912906-94-6 | 5-(Chloromethyl)-1-(4-fluorophenyl)-1H-tetrazole
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
2 weeks  
$208.00
- +
250mg
95.0%
2 weeks  
$284.00
- +
1g
95%
2 weeks  
$459.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01AR3D
Chemical Name:
5-(Chloromethyl)-1-(4-fluorophenyl)-1H-tetrazole
CAS Number:
912906-94-6
Molecular Formula:
C8H6ClFN4
Molecular Weight:
212.6114
MDL Number:
MFCD08548459
IUPAC Name:
5-(chloromethyl)-1-(4-fluorophenyl)tetrazole
InChI:
InChI=1S/C8H6ClFN4/c9-5-8-11-12-13-14(8)7-3-1-6(10)2-4-7/h1-4H,5H2
InChI Key:
FIGNQIBUPZMKSM-UHFFFAOYSA-N
SMILES:
ClCc1nnnn1c1ccc(cc1)F
Properties
Computed Properties
 
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.027g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.612g/mol
Monoisotopic Mass:
212.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
5-(chloromethyl)-1-(4-fluorophenyl)-1H-tetrazole 
912906-94-6 
ST4135359 
VU0421972-2 
L-3322 
F3317-0009 
5-(chloromethyl)-1-(4-fluorophenyl)-1,2,3,4-tetrazole 
5-(chloromethyl)-1-(4-fluorophenyl)-1H-1,2,3,4-tetraazole 
5-(chloromethyl)-1-(4-fluorophenyl)tetrazole 
5-(chloromethyl)-1-(4-fluorophenyl)-1,2,3,4-tetraazole 
BBL012807 
MFCD08548459 
SBB043952 
STK786695 
ZINC11757528 
AKOS000274311 
MCULE-5339088686 
Literature
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