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682326-97-2 | 3-(1H-1,2,3-Triazol-1-yl)piperidine
CAS No: 682326-97-2 Catalog No: AG005LOS MDL No:MFCD15072069
Product Description
Catalog Number:
AG005LOS
Chemical Name:
3-(1H-1,2,3-Triazol-1-yl)piperidine
CAS Number:
682326-97-2
Molecular Formula:
C7H12N4
Molecular Weight:
152.1970
MDL Number:
MFCD15072069
IUPAC Name:
3-(triazol-1-yl)piperidine
InChI:
InChI=1S/C7H12N4/c1-2-7(6-8-3-1)11-5-4-9-10-11/h4-5,7-8H,1-3,6H2
InChI Key:
KGXBEJFERUBKKY-UHFFFAOYSA-N
SMILES:
C1CCC(CN1)n1nncc1
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Isotope Atom Count:
0
Molecular Weight:
152.201g/mol
Monoisotopic Mass:
152.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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