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Home Other Building Blocks 1-Benzyl-4-(diethoxymethyl)-1,2,3-triazole

1-Benzyl-4-(diethoxymethyl)-1,2,3-triazole

CAS No.:
133735-81-6
Catalog Number:
AG00HSZ8
Molecular Formula:
C14H19N3O2
Molecular Weight:
261.3196
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$400
- +
5g
96%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00HSZ8
Chemical Name:
1-Benzyl-4-(diethoxymethyl)-1,2,3-triazole
CAS Number:
133735-81-6
Molecular Formula:
C14H19N3O2
Molecular Weight:
261.3196
MDL Number:
MFCD21715216
IUPAC Name:
1-benzyl-4-(diethoxymethyl)triazole
InChI:
InChI=1S/C14H19N3O2/c1-3-18-14(19-4-2)13-11-17(16-15-13)10-12-8-6-5-7-9-12/h5-9,11,14H,3-4,10H2,1-2H3
InChI Key:
ORQBAXPHPFNXLN-UHFFFAOYSA-N
SMILES:
CCOC(c1nnn(c1)Cc1ccccc1)OCC
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.148g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.325g/mol
Monoisotopic Mass:
261.148g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Synthesis and antibiotic activity of a small molecules library of 1,2,3-triazole derivatives. Bioorganic & medicinal chemistry letters 20080201
Properties