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Home > Pyridines > 2059945-26-3
2059945-26-3 | 2-{3,7-dioxabicyclo[4.1.0]heptan-6-yl}pyridine
CAS No: 2059945-26-3 Catalog No: AG01BQDG MDL No:MFCD30501308
Product Description
Catalog Number:
AG01BQDG
Chemical Name:
2-{3,7-dioxabicyclo[4.1.0]heptan-6-yl}pyridine
CAS Number:
2059945-26-3
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD30501308
IUPAC Name:
2-(3,7-dioxabicyclo[4.1.0]heptan-6-yl)pyridine
InChI:
InChI=1S/C10H11NO2/c1-2-5-11-8(3-1)10-4-6-12-7-9(10)13-10/h1-3,5,9H,4,6-7H2
InChI Key:
DJSFEOTVAPNFGV-UHFFFAOYSA-N
SMILES:
O1CCC2(C(C1)O2)c1ccccn1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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