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14451-85-5 | Tricyclo[3.3.1.13,7]decan-2-ol, 2-propyl-
CAS No: 14451-85-5 Catalog No: AG001JP0 MDL No:
Product Description
Catalog Number:
AG001JP0
Chemical Name:
Tricyclo[3.3.1.13,7]decan-2-ol, 2-propyl-
CAS Number:
14451-85-5
Molecular Formula:
C13H22O
Molecular Weight:
194.3132
IUPAC Name:
2-propyladamantan-2-ol
InChI:
InChI=1S/C13H22O/c1-2-3-13(14)11-5-9-4-10(7-11)8-12(13)6-9/h9-12,14H,2-8H2,1H3
InChI Key:
SEFJJPZJVPVBQK-UHFFFAOYSA-N
SMILES:
CCCC1(O)C2CC3CC1CC(C2)C3
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.318g/mol
Monoisotopic Mass:
194.167g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Comparisons of the influenza virus A M2 channel binding affinities, anti-influenza virus potencies and NMDA antagonistic activities of 2-alkyl-2-aminoadamantanes and analogues. | Bioorganic & medicinal chemistry letters 20081201 |
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