Home Other Building Blocks 3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine dihydrochloride

3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine dihydrochloride

CAS No.:
1308647-41-7
Catalog Number:
AG01ABFF
Molecular Formula:
C9H18Cl2N4
Molecular Weight:
253.1720
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Product Description
Catalog Number:
AG01ABFF
Chemical Name:
3-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidine dihydrochloride
CAS Number:
1308647-41-7
Molecular Formula:
C9H18Cl2N4
Molecular Weight:
253.1720
MDL Number:
MFCD18089391
IUPAC Name:
3-(4-ethyl-1,2,4-triazol-3-yl)piperidine;dihydrochloride
InChI:
InChI=1S/C9H16N4.2ClH/c1-2-13-7-11-12-9(13)8-4-3-5-10-6-8;;/h7-8,10H,2-6H2,1H3;2*1H
InChI Key:
IEVFAKCYSXGOTI-UHFFFAOYSA-N
SMILES:
CCn1cnnc1C1CCCNC1.Cl.Cl
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.091g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
253.171g/mol
Monoisotopic Mass:
252.091g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties