Home Other Building Blocks 3-(1H-Tetrazol-5-yl)benzylamine

3-(1H-Tetrazol-5-yl)benzylamine

CAS No.:
765877-97-2
Catalog Number:
AG003HZI
Molecular Formula:
C8H9N5
Molecular Weight:
175.1906
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>97%
In Stock USA
United States
$839
- +
Product Description
Catalog Number:
AG003HZI
Chemical Name:
3-(1H-Tetrazol-5-yl)benzylamine
CAS Number:
765877-97-2
Molecular Formula:
C8H9N5
Molecular Weight:
175.1906
MDL Number:
MFCD09971259
IUPAC Name:
[3-(2H-tetrazol-5-yl)phenyl]methanamine
InChI:
InChI=1S/C8H9N5/c9-5-6-2-1-3-7(4-6)8-10-12-13-11-8/h1-4H,5,9H2,(H,10,11,12,13)
InChI Key:
CRCMTYUJTYRWAX-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)c1n[nH]nn1
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.086g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
175.195g/mol
Monoisotopic Mass:
175.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties