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Home > Pyridines > 820231-76-3
820231-76-3 | 3-Pyridinehexanol, 5-[[(2S)-1-methyl-2-pyrrolidinyl]methoxy]-
CAS No: 820231-76-3 Catalog No: AG005D9S MDL No:
Product Description
Catalog Number:
AG005D9S
Chemical Name:
3-Pyridinehexanol, 5-[[(2S)-1-methyl-2-pyrrolidinyl]methoxy]-
CAS Number:
820231-76-3
Molecular Formula:
C17H28N2O2
Molecular Weight:
292.4164
IUPAC Name:
6-[5-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]pyridin-3-yl]hexan-1-ol
InChI:
InChI=1S/C17H28N2O2/c1-19-9-6-8-16(19)14-21-17-11-15(12-18-13-17)7-4-2-3-5-10-20/h11-13,16,20H,2-10,14H2,1H3/t16-/m0/s1
InChI Key:
WPEUZXAWBXRQMT-INIZCTEOSA-N
SMILES:
OCCCCCCc1cncc(c1)OC[C@@H]1CCCN1C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
292.215g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.423g/mol
Monoisotopic Mass:
292.215g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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