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88664-46-4 | Pyridine, 2-[[(2-ethyl-1,8-dioxaspiro[4.5]dec-2-yl)methoxy]methyl]-
CAS No: 88664-46-4 Catalog No: AG0048DH MDL No:
Product Description
Catalog Number:
AG0048DH
Chemical Name:
Pyridine, 2-[[(2-ethyl-1,8-dioxaspiro[4.5]dec-2-yl)methoxy]methyl]-
CAS Number:
88664-46-4
Molecular Formula:
C17H25NO3
Molecular Weight:
291.3853
IUPAC Name:
2-[(2-ethyl-1,8-dioxaspiro[4.5]decan-2-yl)methoxymethyl]pyridine
InChI:
InChI=1S/C17H25NO3/c1-2-16(14-20-13-15-5-3-4-10-18-15)6-7-17(21-16)8-11-19-12-9-17/h3-5,10H,2,6-9,11-14H2,1H3
InChI Key:
RNKLGFNRXCVTHE-UHFFFAOYSA-N
SMILES:
CCC1(COCc2ccccn2)CCC2(O1)CCOCC2
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.183g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.391g/mol
Monoisotopic Mass:
291.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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