Home Other Building Blocks 2-benzyl-2H-1,2,3,4-tetrazol-5-amine

2-benzyl-2H-1,2,3,4-tetrazol-5-amine

CAS No.:
31694-91-4
Catalog Number:
AG019QZX
Molecular Formula:
C8H9N5
Molecular Weight:
175.1906
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Product Description
Catalog Number:
AG019QZX
Chemical Name:
2-benzyl-2H-1,2,3,4-tetrazol-5-amine
CAS Number:
31694-91-4
Molecular Formula:
C8H9N5
Molecular Weight:
175.1906
MDL Number:
MFCD02689458
IUPAC Name:
2-benzyltetrazol-5-amine
InChI:
InChI=1S/C8H9N5/c9-8-10-12-13(11-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,11)
InChI Key:
SYWWVUJXAAINHI-UHFFFAOYSA-N
SMILES:
Nc1nnn(n1)Cc1ccccc1
Properties
Complexity:
157  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
175.195g/mol
Monoisotopic Mass:
175.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties