Home Halogens 5-(chloromethyl)-1-cyclobutyl-1H-1,2,3,4-tetrazole

5-(chloromethyl)-1-cyclobutyl-1H-1,2,3,4-tetrazole

CAS No.:
1344114-53-9
Catalog Number:
AG01ABRS
Molecular Formula:
C6H9ClN4
Molecular Weight:
172.6155
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Product Description
Catalog Number:
AG01ABRS
Chemical Name:
5-(chloromethyl)-1-cyclobutyl-1H-1,2,3,4-tetrazole
CAS Number:
1344114-53-9
Molecular Formula:
C6H9ClN4
Molecular Weight:
172.6155
MDL Number:
MFCD16863293
IUPAC Name:
5-(chloromethyl)-1-cyclobutyltetrazole
InChI:
InChI=1S/C6H9ClN4/c7-4-6-8-9-10-11(6)5-2-1-3-5/h5H,1-4H2
InChI Key:
BFIDHAGNSMWGLS-UHFFFAOYSA-N
SMILES:
ClCc1nnnn1C1CCC1
Properties
Complexity:
139  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.052g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.616g/mol
Monoisotopic Mass:
172.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties