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20548-02-1

20548-02-1 | Cyclohexanone, 4-hydroxy-2,2,6-trimethyl-

CAS No: 20548-02-1 Catalog No: AG002A3X MDL No:MFCD24688364

Product Description

Catalog Number:
AG002A3X
Chemical Name:
Cyclohexanone, 4-hydroxy-2,2,6-trimethyl-
CAS Number:
20548-02-1
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
MDL Number:
MFCD24688364
IUPAC Name:
4-hydroxy-2,2,6-trimethylcyclohexan-1-one
InChI:
InChI=1S/C9H16O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6-7,10H,4-5H2,1-3H3
InChI Key:
CSPVUHYZUZZRGF-UHFFFAOYSA-N
SMILES:
OC1CC(C)C(=O)C(C1)(C)C
UNII:
X5GI5QTU0I

Properties

Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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