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Home > Other Heterocycles > 960079-47-4
960079-47-4 | 2-Phenyl-2,6-diazaspiro[3.3]heptan-1-one
CAS No: 960079-47-4 Catalog No: AG00IJQM MDL No:MFCD13180714
Product Description
Catalog Number:
AG00IJQM
Chemical Name:
2-Phenyl-2,6-diazaspiro[3.3]heptan-1-one
CAS Number:
960079-47-4
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD13180714
IUPAC Name:
2-phenyl-2,6-diazaspiro[3.3]heptan-3-one
InChI:
InChI=1S/C11H12N2O/c14-10-11(6-12-7-11)8-13(10)9-4-2-1-3-5-9/h1-5,12H,6-8H2
InChI Key:
JGOYKNYAYFJVST-UHFFFAOYSA-N
SMILES:
O=C1N(CC21CNC2)c1ccccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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