Home Other Building Blocks 4-(1H-1,2,4-triazol-1-ylmethyl)piperidine

4-(1H-1,2,4-triazol-1-ylmethyl)piperidine

CAS No.:
1211590-58-7
Catalog Number:
AG01ACB2
Molecular Formula:
C8H14N4
Molecular Weight:
166.2236
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ACB2
Chemical Name:
4-(1H-1,2,4-triazol-1-ylmethyl)piperidine
CAS Number:
1211590-58-7
Molecular Formula:
C8H14N4
Molecular Weight:
166.2236
MDL Number:
MFCD16075995
IUPAC Name:
4-(1,2,4-triazol-1-ylmethyl)piperidine
InChI:
InChI=1S/C8H14N4/c1-3-9-4-2-8(1)5-12-7-10-6-11-12/h6-9H,1-5H2
InChI Key:
ZLGCTFLARAWVND-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)Cn1ncnc1
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.122g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.228g/mol
Monoisotopic Mass:
166.122g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties