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Home > Other Heterocycles > 116424-07-8
116424-07-8 | 5,8-Dioxa-1-azaspiro[3.4]octan-2-one, 6-methyl-1-phenyl-
CAS No: 116424-07-8 Catalog No: AG000CHI MDL No:
Product Description
Catalog Number:
AG000CHI
Chemical Name:
5,8-Dioxa-1-azaspiro[3.4]octan-2-one, 6-methyl-1-phenyl-
CAS Number:
116424-07-8
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
IUPAC Name:
7-methyl-1-phenyl-5,8-dioxa-1-azaspiro[3.4]octan-2-one
InChI:
InChI=1S/C12H13NO3/c1-9-8-15-12(16-9)7-11(14)13(12)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChI Key:
UMDYRSFOGCXCRA-UHFFFAOYSA-N
SMILES:
CC1COC2(O1)CC(=O)N2c1ccccc1
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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