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69625-62-3 | 1H-1,2,4-Triazole,1-tricyclo[3.3.1.13,7]dec-1-yl-
CAS No: 69625-62-3 Catalog No: AG005JYH MDL No:
Product Description
Catalog Number:
AG005JYH
Chemical Name:
1H-1,2,4-Triazole,1-tricyclo[3.3.1.13,7]dec-1-yl-
CAS Number:
69625-62-3
Molecular Formula:
C12H17N3
Molecular Weight:
203.2835
IUPAC Name:
1-(1-adamantyl)-1,2,4-triazole
InChI:
InChI=1S/C12H17N3/c1-9-2-11-3-10(1)5-12(4-9,6-11)15-8-13-7-14-15/h7-11H,1-6H2
InChI Key:
ZBBZETXZKFHHLA-UHFFFAOYSA-N
SMILES:
C1C2CC3CC1CC(C2)(C3)n1ncnc1
NSC Number:
283156
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.289g/mol
Monoisotopic Mass:
203.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Synthesis and anti-viral activity of azolo-adamantanes against influenza A virus. | Bioorganic & medicinal chemistry 20100115 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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