Home Other Building Blocks 5-(Chloromethyl)-1-(4-fluorophenyl)-1H-tetrazole

5-(Chloromethyl)-1-(4-fluorophenyl)-1H-tetrazole

CAS No.:
912906-94-6
Catalog Number:
AG01AR65
Molecular Formula:
C8H6ClFN4
Molecular Weight:
212.6114
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Product Description
Catalog Number:
AG01AR65
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
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  
Properties