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Home > Other Heterocycles > 2060047-73-4
2060047-73-4 | 8-(3-methoxyphenyl)-6-azaspiro[3.4]octan-5-one
CAS No: 2060047-73-4 Catalog No: AG01BYQR MDL No:MFCD30487317
Product Description
Catalog Number:
AG01BYQR
Chemical Name:
8-(3-methoxyphenyl)-6-azaspiro[3.4]octan-5-one
CAS Number:
2060047-73-4
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
MDL Number:
MFCD30487317
IUPAC Name:
8-(3-methoxyphenyl)-6-azaspiro[3.4]octan-5-one
InChI:
InChI=1S/C14H17NO2/c1-17-11-5-2-4-10(8-11)12-9-15-13(16)14(12)6-3-7-14/h2,4-5,8,12H,3,6-7,9H2,1H3,(H,15,16)
InChI Key:
RBHIJCYVSHVMTR-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C1CNC(=O)C21CCC2
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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