Home Other Building Blocks 2-(1H-1,2,3-triazol-1-ylmethyl)piperidine dihydrochloride

2-(1H-1,2,3-triazol-1-ylmethyl)piperidine dihydrochloride

CAS No.:
1432679-74-7
Catalog Number:
AG01A459
Molecular Formula:
C8H16Cl2N4
Molecular Weight:
239.1454
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Product Description
Catalog Number:
AG01A459
Chemical Name:
2-(1H-1,2,3-triazol-1-ylmethyl)piperidine dihydrochloride
CAS Number:
1432679-74-7
Molecular Formula:
C8H16Cl2N4
Molecular Weight:
239.1454
MDL Number:
MFCD23701799
IUPAC Name:
2-(triazol-1-ylmethyl)piperidine;dihydrochloride
InChI:
InChI=1S/C8H14N4.2ClH/c1-2-4-9-8(3-1)7-12-6-5-10-11-12;;/h5-6,8-9H,1-4,7H2;2*1H
InChI Key:
QIEOJMFDNWCCRH-UHFFFAOYSA-N
SMILES:
C1CCC(NC1)Cn1nncc1.Cl.Cl
Properties
Complexity:
139  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
239.144g/mol
Monoisotopic Mass:
238.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties