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161644-20-8

161644-20-8 | 1-Azaspiro[4.5]deca-1,6,9-trien-8-one, 2-methyl-

CAS No: 161644-20-8 Catalog No: AG001VR9 MDL No:

Product Description

Catalog Number:
AG001VR9
Chemical Name:
1-Azaspiro[4.5]deca-1,6,9-trien-8-one, 2-methyl-
CAS Number:
161644-20-8
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
2-methyl-1-azaspiro[4.5]deca-1,6,9-trien-8-one
InChI:
InChI=1S/C10H11NO/c1-8-2-5-10(11-8)6-3-9(12)4-7-10/h3-4,6-7H,2,5H2,1H3
InChI Key:
LYIYYIHHKUVHDI-UHFFFAOYSA-N
SMILES:
O=C1C=CC2(C=C1)CCC(=N2)C

Properties

Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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