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Home > Other Heterocycles > 522633-54-1
522633-54-1 | 1-Azaspiro[5.5]undeca-7,10-dien-9-one, 8-hydroxy-1-propyl-
CAS No: 522633-54-1 Catalog No: AG006VGM MDL No:
Product Description
Catalog Number:
AG006VGM
Chemical Name:
1-Azaspiro[5.5]undeca-7,10-dien-9-one, 8-hydroxy-1-propyl-
CAS Number:
522633-54-1
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
IUPAC Name:
10-hydroxy-1-propyl-1-azaspiro[5.5]undeca-7,10-dien-9-one
InChI:
InChI=1S/C13H19NO2/c1-2-8-14-9-4-3-6-13(14)7-5-11(15)12(16)10-13/h5,7,10,16H,2-4,6,8-9H2,1H3
InChI Key:
JGLIGOBBZRYCFY-UHFFFAOYSA-N
SMILES:
CCCN1CCCCC21C=CC(=O)C(=C2)O
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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