Home Other Building Blocks 1-(2,6-DIMETHYLPHENYL)-1H-1,2,3,4-TETRAZOL-5-AMINE

1-(2,6-DIMETHYLPHENYL)-1H-1,2,3,4-TETRAZOL-5-AMINE

CAS No.:
127866-81-3
Catalog Number:
AG01DV6D
Molecular Formula:
C9H11N5
Molecular Weight:
189.2171
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Product Description
Catalog Number:
AG01DV6D
Chemical Name:
1-(2,6-DIMETHYLPHENYL)-1H-1,2,3,4-TETRAZOL-5-AMINE
CAS Number:
127866-81-3
Molecular Formula:
C9H11N5
Molecular Weight:
189.2171
MDL Number:
MFCD20697524
IUPAC Name:
1-(2,6-dimethylphenyl)tetrazol-5-amine
InChI:
InChI=1S/C9H11N5/c1-6-4-3-5-7(2)8(6)14-9(10)11-12-13-14/h3-5H,1-2H3,(H2,10,11,13)
InChI Key:
GUKRUMMXLOLWCY-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1n1nnnc1N)C
NSC Number:
138014
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.101g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.222g/mol
Monoisotopic Mass:
189.101g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties