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100182-82-9

100182-82-9 | Cyclohexanone, (1,1-dimethylethyl)-

CAS No: 100182-82-9 Catalog No: AG000164 MDL No:

Product Description

Catalog Number:
AG000164
Chemical Name:
Cyclohexanone, (1,1-dimethylethyl)-
CAS Number:
100182-82-9
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
2-tert-butylcyclohexan-1-one
InChI:
InChI=1S/C10H18O/c1-10(2,3)8-6-4-5-7-9(8)11/h8H,4-7H2,1-3H3
InChI Key:
ZRYDPLOWJSFQAE-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1C(C)(C)C
EC Number:
217-043-8

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Literature

Title Journal
Nickel supported carbon nanofibers as an active and selective catalyst for the gas-phase hydrogenation of 2-tert-butylphenol. Journal of colloid and interface science 20120815
Asymmetric solid-phase alkylation of ketones immobilized via SAMP hydrazone analogue linkers. Journal of combinatorial chemistry 20080101
Biologically active contaminants of intravenous saline in PVC packaging: Australasian, European, and North American samples. Anaesthesia and intensive care 20050201

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