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Home > Other Heterocycles > 2060042-42-2
2060042-42-2 | 8-(3-methylphenyl)-6-azaspiro[3.4]octan-5-one
CAS No: 2060042-42-2 Catalog No: AG01BYQZ MDL No:MFCD30487325
Product Description
Catalog Number:
AG01BYQZ
Chemical Name:
8-(3-methylphenyl)-6-azaspiro[3.4]octan-5-one
CAS Number:
2060042-42-2
Molecular Formula:
C14H17NO
Molecular Weight:
215.2909
MDL Number:
MFCD30487325
IUPAC Name:
8-(3-methylphenyl)-6-azaspiro[3.4]octan-5-one
InChI:
InChI=1S/C14H17NO/c1-10-4-2-5-11(8-10)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:
RQWWKWBCRFJUGD-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C1CNC(=O)C21CCC2
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.296g/mol
Monoisotopic Mass:
215.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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