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Home > Other Heterocycles > 89241-16-7
89241-16-7 | 1-Oxa-2-azaspiro[2.4]heptane, 2-[2-(3,4-dimethoxyphenyl)ethyl]-
CAS No: 89241-16-7 Catalog No: AG0042MO MDL No:
Product Description
Catalog Number:
AG0042MO
Chemical Name:
1-Oxa-2-azaspiro[2.4]heptane, 2-[2-(3,4-dimethoxyphenyl)ethyl]-
CAS Number:
89241-16-7
Molecular Formula:
C15H21NO3
Molecular Weight:
263.3321
IUPAC Name:
2-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxa-2-azaspiro[2.4]heptane
InChI:
InChI=1S/C15H21NO3/c1-17-13-6-5-12(11-14(13)18-2)7-10-16-15(19-16)8-3-4-9-15/h5-6,11H,3-4,7-10H2,1-2H3
InChI Key:
GJBZWNJOTGGETM-UHFFFAOYSA-N
SMILES:
COc1cc(CCN2OC32CCCC3)ccc1OC
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.337g/mol
Monoisotopic Mass:
263.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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