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40247-47-0 | 3-(Pyridin-3-yl)pentan-3-ol
CAS No: 40247-47-0 Catalog No: AG01EVU3 MDL No:
Product Description
Catalog Number:
AG01EVU3
Chemical Name:
3-(Pyridin-3-yl)pentan-3-ol
CAS Number:
40247-47-0
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
IUPAC Name:
3-pyridin-3-ylpentan-3-ol
InChI:
InChI=1S/C10H15NO/c1-3-10(12,4-2)9-6-5-7-11-8-9/h5-8,12H,3-4H2,1-2H3
InChI Key:
OOUDHACWMKVPHZ-UHFFFAOYSA-N
SMILES:
CCC(c1cccnc1)(CC)O
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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