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Home > Other Heterocycles > 2060043-47-0
2060043-47-0 | 8-[4-(propan-2-yl)phenyl]-6-azaspiro[3.4]octan-5-one
CAS No: 2060043-47-0 Catalog No: AG01BYQS MDL No:MFCD30487318
Product Description
Catalog Number:
AG01BYQS
Chemical Name:
8-[4-(propan-2-yl)phenyl]-6-azaspiro[3.4]octan-5-one
CAS Number:
2060043-47-0
Molecular Formula:
C16H21NO
Molecular Weight:
243.3440
MDL Number:
MFCD30487318
IUPAC Name:
8-(4-propan-2-ylphenyl)-6-azaspiro[3.4]octan-5-one
InChI:
InChI=1S/C16H21NO/c1-11(2)12-4-6-13(7-5-12)14-10-17-15(18)16(14)8-3-9-16/h4-7,11,14H,3,8-10H2,1-2H3,(H,17,18)
InChI Key:
DDVXHWFTSCESLW-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C1CNC(=O)C21CCC2)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.162g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.35g/mol
Monoisotopic Mass:
243.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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