Home Halogens 5-(chloromethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazole

5-(chloromethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazole

CAS No.:
1094265-93-6
Catalog Number:
AG019W6Z
Molecular Formula:
C9H6ClF3N4
Molecular Weight:
262.6189
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019W6Z
Chemical Name:
5-(chloromethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazole
CAS Number:
1094265-93-6
Molecular Formula:
C9H6ClF3N4
Molecular Weight:
262.6189
MDL Number:
MFCD11134247
IUPAC Name:
5-(chloromethyl)-1-[4-(trifluoromethyl)phenyl]tetrazole
InChI:
InChI=1S/C9H6ClF3N4/c10-5-8-14-15-16-17(8)7-3-1-6(2-4-7)9(11,12)13/h1-4H,5H2
InChI Key:
BGMCBLPBPUTNCH-UHFFFAOYSA-N
SMILES:
ClCc1nnnn1c1ccc(cc1)C(F)(F)F
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.023g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.62g/mol
Monoisotopic Mass:
262.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties