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Home > Other Heterocycles > 89241-17-8
89241-17-8 | 1-Oxa-2-azaspiro[2.4]heptane, 2-[2-(1,3-benzodioxol-5-yl)ethyl]-
CAS No: 89241-17-8 Catalog No: AG0042MN MDL No:
Product Description
Catalog Number:
AG0042MN
Chemical Name:
1-Oxa-2-azaspiro[2.4]heptane, 2-[2-(1,3-benzodioxol-5-yl)ethyl]-
CAS Number:
89241-17-8
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
IUPAC Name:
2-[2-(1,3-benzodioxol-5-yl)ethyl]-1-oxa-2-azaspiro[2.4]heptane
InChI:
InChI=1S/C14H17NO3/c1-2-7-14(6-1)15(18-14)8-5-11-3-4-12-13(9-11)17-10-16-12/h3-4,9H,1-2,5-8,10H2
InChI Key:
MKDYVEPPMPBTGE-UHFFFAOYSA-N
SMILES:
C1CCC2(C1)ON2CCc1ccc2c(c1)OCO2
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.294g/mol
Monoisotopic Mass:
247.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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