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Home > Pyridines > 851761-77-8
851761-77-8 | 1-Butanol, 4-(3-pyridinylmethoxy)-
CAS No: 851761-77-8 Catalog No: AG004QOC MDL No:
Product Description
Catalog Number:
AG004QOC
Chemical Name:
1-Butanol, 4-(3-pyridinylmethoxy)-
CAS Number:
851761-77-8
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
IUPAC Name:
4-(pyridin-3-ylmethoxy)butan-1-ol
InChI:
InChI=1S/C10H15NO2/c12-6-1-2-7-13-9-10-4-3-5-11-8-10/h3-5,8,12H,1-2,6-7,9H2
InChI Key:
LHIIYGBUWDUELR-UHFFFAOYSA-N
SMILES:
OCCCCOCc1cccnc1
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.11g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.235g/mol
Monoisotopic Mass:
181.11g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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