341258
4,4-Dimethyl-1,3-cyclohexanedione
98%
Manufacturer: Sigma Aldrich
CAS Number: 562-46-9
Select a Size
| Pack Size | SKU | Availability | Price |
|---|---|---|---|
| 5 G | 341258-5-G | In Stock | ₹ 6,181.08 |
341258 - 5 G
In Stock
Quantity
1
Base Price: ₹ 6,181.08
GST (18%): ₹ 1,112.594
Total Price: ₹ 7,293.674
Quality Level
100
Assay
98%
bp
130 °C/7 mmHg (lit.)
mp
103-105 °C (lit.)
SMILES string
CC1(C)CCC(=O)CC1=O
InChI
1S/C8H12O2/c1-8(2)4-3-6(9)5-7(8)10/h3-5H2,1-2H3
InChI key
PLGPBTCNKJQJHQ-UHFFFAOYSA-N
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 4,4-Dimethylcyclohexane-1,3-dione | ChemScene | ₹ 2,737.92 - ₹ 39,528.72 | |
 | 562-46-9 | 4,4-Dimethyl-1,3-cyclohexanedione | A2B Chem | ₹ 1,026.72 - ₹ 7,957.08 |
Description
- General description: Standard molar enthalpy of formation of 4,4-dimethyl-1,3-cyclohexanedione in the gaseous state at 298.15K has been determined.[1]
- Application: 4,4-Dimethyl-1,3-cyclohexanedione was employed in the synthesis of series of 4-aryl-6,6-dimethyl-1,2,3,4,5,6,7,8- octahydroquinazoline-2,5-diones via Biginelli reaction.[2]
SAFETY INFORMATION
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Show Difference
Quality Level: 100
Assay: 98%
bp: 130 °C/7 mmHg (lit.)
mp: 103-105 °C (lit.)
SMILES string: CC1(C)CCC(=O)CC1=O
InChI: 1S/C8H12O2/c1-8(2)4-3-6(9)5-7(8)10/h3-5H2,1-2H3
InChI key: PLGPBTCNKJQJHQ-UHFFFAOYSA-N
Quality Level:
100
Assay:
98%
bp:
130 °C/7 mmHg (lit.)
mp:
103-105 °C (lit.)
SMILES string:
CC1(C)CCC(=O)CC1=O
InChI:
1S/C8H12O2/c1-8(2)4-3-6(9)5-7(8)10/h3-5H2,1-2H3
InChI key:
PLGPBTCNKJQJHQ-UHFFFAOYSA-N
Quality Level: 200
Assay: __
bp: __
mp: __
SMILES string: OC1=C(C(O[C@@H](C)CCC2)=O)C(/C=C/CCCC2=O)=CC(O)=C1
InChI: 1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1
InChI key: __
Quality Level:
200
Assay:
__
bp:
__
mp:
__
SMILES string:
OC1=C(C(O[C@@H](C)CCC2)=O)C(/C=C/CCCC2=O)=CC(O)=C1
InChI:
1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1
InChI key:
__
Quality Level: 100
Assay: 99%
bp: __
mp: 63-65 °C (lit.)
SMILES string: CC1(C)OC(=O)C2(CC2)C(=O)O1
InChI: 1S/C8H10O4/c1-7(2)11-5(9)8(3-4-8)6(10)12-7/h3-4H2,1-2H3
InChI key: AXJVPXNVESYGDT-UHFFFAOYSA-N
Quality Level:
100
Assay:
99%
bp:
__
mp:
63-65 °C (lit.)
SMILES string:
CC1(C)OC(=O)C2(CC2)C(=O)O1
InChI:
1S/C8H10O4/c1-7(2)11-5(9)8(3-4-8)6(10)12-7/h3-4H2,1-2H3
InChI key:
AXJVPXNVESYGDT-UHFFFAOYSA-N
Quality Level: 100
Assay: __
bp: __
mp: __
SMILES string: OC1OCC=C2OC(=O)C=C12
InChI: 1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2
InChI key: __
Quality Level:
100
Assay:
__
bp:
__
mp:
__
SMILES string:
OC1OCC=C2OC(=O)C=C12
InChI:
1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2
InChI key:
__