Home Halogens 2H-Tetrazole, 5-[(4-chlorophenyl)methyl]-

2H-Tetrazole, 5-[(4-chlorophenyl)methyl]-

CAS No.:
14064-61-0
Catalog Number:
AG001CMM
Molecular Formula:
C8H7ClN4
Molecular Weight:
194.6210
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$858
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Product Description
Catalog Number:
AG001CMM
Chemical Name:
2H-Tetrazole, 5-[(4-chlorophenyl)methyl]-
CAS Number:
14064-61-0
Molecular Formula:
C8H7ClN4
Molecular Weight:
194.6210
MDL Number:
MFCD00205200
IUPAC Name:
5-[(4-chlorophenyl)methyl]-2H-tetrazole
InChI:
InChI=1S/C8H7ClN4/c9-7-3-1-6(2-4-7)5-8-10-12-13-11-8/h1-4H,5H2,(H,10,11,12,13)
InChI Key:
PNVBWDXECSSTFP-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Cc1n[nH]nn1
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.036g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.622g/mol
Monoisotopic Mass:
194.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties