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1604436-77-2

1604436-77-2 | Piperidine, 2-(1H-1,2,4-triazol-5-yl)-, (2R)-

CAS No: 1604436-77-2 Catalog No: AG001RX2 MDL No:

Product Description

Catalog Number:
AG001RX2
Chemical Name:
Piperidine, 2-(1H-1,2,4-triazol-5-yl)-, (2R)-
CAS Number:
1604436-77-2
Molecular Formula:
C7H12N4
Molecular Weight:
152.1970
IUPAC Name:
(2R)-2-(1H-1,2,4-triazol-5-yl)piperidine
InChI:
InChI=1S/C7H12N4/c1-2-4-8-6(3-1)7-9-5-10-11-7/h5-6,8H,1-4H2,(H,9,10,11)/t6-/m1/s1
InChI Key:
RONDMOYIJWDSEP-ZCFIWIBFSA-N
SMILES:
C1CC[C@@H](NC1)c1ncn[nH]1

Properties

Complexity:
128  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
152.106g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
152.201g/mol
Monoisotopic Mass:
152.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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