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810682-18-9

810682-18-9 | 1,3-Dioxaspiro[4.5]decan-7-one,2,2,6,6,8-pentamethyl-,(5S)-(9CI)

CAS No: 810682-18-9 Catalog No: AG00GQ19 MDL No:

Product Description

Catalog Number:
AG00GQ19
Chemical Name:
1,3-Dioxaspiro[4.5]decan-7-one,2,2,6,6,8-pentamethyl-,(5S)-(9CI)
CAS Number:
810682-18-9
IUPAC Name:
(5S)-2,2,6,6,8-pentamethyl-1,3-dioxaspiro[4.5]decan-7-one
InChI:
InChI=1S/C13H22O3/c1-9-6-7-13(11(2,3)10(9)14)8-15-12(4,5)16-13/h9H,6-8H2,1-5H3/t9?,13-/m1/s1
InChI Key:
GQDGYIPJMKFXRF-WCRCJTMVSA-N

Properties

Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
226.157g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.316g/mol
Monoisotopic Mass:
226.157g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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