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82106-08-9 | 1-Phenyl-3-(pyridin-4-yl)propan-1-ol
CAS No: 82106-08-9 Catalog No: AG01EXJN MDL No:
Product Description
Catalog Number:
AG01EXJN
Chemical Name:
1-Phenyl-3-(pyridin-4-yl)propan-1-ol
CAS Number:
82106-08-9
Molecular Formula:
C14H15NO
Molecular Weight:
213.2750
IUPAC Name:
1-phenyl-3-pyridin-4-ylpropan-1-ol
InChI:
InChI=1S/C14H15NO/c16-14(13-4-2-1-3-5-13)7-6-12-8-10-15-11-9-12/h1-5,8-11,14,16H,6-7H2
InChI Key:
XGBCDHNPEDEGIE-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)CCc1ccncc1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.28g/mol
Monoisotopic Mass:
213.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| 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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