(E)-(±)-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
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Product Description
Product
(E)-(±)-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
CAS
30685-95-1
Formula
C13H20O
Typical Product Specifications
InChIKey
1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+
Henry's Law Constant
1.81E-04 atm-m3/mole
Water solubility
1.00E+06 mg/L
log P (octanol-water)
3.85
Atmospheric OH Rate Constant
1.43E-10 cm3/molecule-sec
Melting Point
< 25 ° C
Molecular weight
192.30
SMILES
C1([C@@H](C(=CCC1)C)\C=C\C(C)=O)(C)C
InChI
UZFLPKAIBPNNCA-BQYQJAHWSA-N
Class
(E)-(±)-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
Product Description
Product
(E)-(±)-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
CAS
30685-95-1
Formula
C13H20O
Typical Product Specifications
InChIKey
1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+
Henry's Law Constant
1.81E-04 atm-m3/mole
Water solubility
1.00E+06 mg/L
log P (octanol-water)
3.85
Atmospheric OH Rate Constant
1.43E-10 cm3/molecule-sec
Melting Point
< 25 ° C
Molecular weight
192.30
SMILES
C1([C@@H](C(=CCC1)C)\C=C\C(C)=O)(C)C
InChI
UZFLPKAIBPNNCA-BQYQJAHWSA-N
Class
