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Home Other Building Blocks 2,2,6-Trimethyl-4H-1,3-dioxin-4-one

2,2,6-Trimethyl-4H-1,3-dioxin-4-one

CAS No.:
5394-63-8
Catalog Number:
AG003F8W
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
95%
In Stock USA
United States
$57
- +
100g
95%
In Stock USA
United States
$175
- +
Product Description
Catalog Number:
AG003F8W
Chemical Name:
2,2,6-Trimethyl-4H-1,3-dioxin-4-one
CAS Number:
5394-63-8
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
MDL Number:
MFCD00040468
IUPAC Name:
2,2,6-trimethyl-1,3-dioxin-4-one
InChI:
InChI=1S/C7H10O3/c1-5-4-6(8)10-7(2,3)9-5/h4H,1-3H3
InChI Key:
XFRBXZCBOYNMJP-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)OC(O1)(C)C
EC Number:
226-403-3
NSC Number:
2391
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.063g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.154g/mol
Monoisotopic Mass:
142.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Synthesis and cloxacillin antimicrobial enhancement of 2-methylsulfonylimidazolyl-1,4-dihydropyridine derivatives. Daru : journal of Faculty of Pharmacy, Tehran University of Medical Sciences 20100101
Facile syntheses of 2,2-dimethyl-6-(2-oxoalkyl)-1,3-dioxin-4-ones and the corresponding 6-substituted 4-hydroxy-2-pyrones. The Journal of organic chemistry 20050610
Properties