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CAS No.: | 68345-22-2 |
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Name: | FEMA 3384 |
Molecular Structure: | |
Formula: | C16H26O2 |
Molecular Weight: | 250.38 |
Synonyms: | [2,2-bis(2-methylpropoxy)ethyl]-benzen;[2,2-bis(2-methylpropoxy)ethyl]-Benzene;FEMA 3384;Phenyl acetaldehyde diisobutyl acetal;[2,2-Bis[(2-methylpropyl)oxy]ethyl]benzene; |
EINECS: | 269-851-5 |
Density: | 0.933 g/cm3 |
Boiling Point: | 300.9 °C at 760 mmHg |
Flash Point: | 93.4 °C |
PSA: | 18.46000 |
LogP: | 3.90040 |
The CAS register number of Benzene,[2,2-bis(2-methylpropoxy)ethyl]- is 68345-22-2. It also can be called as Phenyl acetaldehyde diisobutyl acetal and the systematic name about this chemical is [2,2-bis(2-methylpropoxy)ethyl]benzene. The molecular formula about this chemical is C16H26O2 and the molecular weight is 250.38.
Physical properties about Benzene,[2,2-bis(2-methylpropoxy)ethyl]- are: (1)ACD/LogP: 4.89; (2)ACD/LogD (pH 5.5): 4.89; (3)ACD/LogD (pH 7.4): 4.89; (4)ACD/BCF (pH 5.5): 3085.64; (5)ACD/BCF (pH 7.4): 3085.64; (6)ACD/KOC (pH 5.5): 10946.32; (7)ACD/KOC (pH 7.4): 10946.32; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 8; (10)Polar Surface Area: 18.46 Å2; (11)Index of Refraction: 1.48; (12)Molar Refractivity: 76.23 cm3; (13)Molar Volume: 268.1 cm3; (14)Polarizability: 30.22x10-24cm3; (15)Surface Tension: 31.1 dyne/cm; (16)Density: 0.933 g/cm3; (17)Flash Point: 93.4 °C; (18)Enthalpy of Vaporization: 51.93 kJ/mol; (19)Boiling Point: 300.9 °C at 760 mmHg; (20)Vapour Pressure: 0.00195 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(C(OCC(C)C)Cc1ccccc1)CC(C)C
(2)InChI: InChI=1/C16H26O2/c1-13(2)11-17-16(18-12-14(3)4)10-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3
(3)InChIKey: IORFKGJOBOCHPX-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C16H26O2/c1-13(2)11-17-16(18-12-14(3)4)10-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3 (5)Std. InChIKey: IORFKGJOBOCHPX-UHFFFAOYSA-N