Chemical Properties of (3-Methylphenyl) methanol, neopentyl ether

(3-Methylphenyl) methanol, neopentyl ether

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InChI
InChI=1S/C13H20O/c1-11-6-5-7-12(8-11)9-14-10-13(2,3)4/h5-8H,9-10H2,1-4H3
InChI Key
AGBLWVRAXHXNJN-UHFFFAOYSA-N
Formula
C13H20O
SMILES
Cc1cccc(COCC(C)(C)C)c1
Molecular Weight1
192.30
Sources

Physical Properties

Property Value Unit Source
Δf 59.20 kJ/mol Joback Calculated Property
Δfgas -227.56 kJ/mol Joback Calculated Property
Δfus 16.85 kJ/mol Joback Calculated Property
Δvap 48.58 kJ/mol Joback Calculated Property
logPoct/wat 3.56 Crippen Calculated Property
Pc 2167.36 kPa Joback Calculated Property
Tboil 547.69 K Joback Calculated Property
Tc 755.69 K Joback Calculated Property
Tfus 299.86 K Joback Calculated Property
Vc 0.66 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 423.50 J/mol×K 547.69 Joback Calculated Property
η 0.00 Pa×s 547.69 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 2
>C< 1
-CH3 4

Similar Compounds

(3-Methylphenyl) methanol, 2-methylpropyl ether. (3-Methylphenyl) methanol, n-propyl. (3-Methylphenyl) methanol, 2-methylbutyl ether. (3-Methylphenyl) methanol, n-butyl ether. (3-Methylphenyl) methanol, 3-methylbutyl ether. (3-Methylphenyl) methanol, n-pentyl ether. (3-Methylphenyl) methanol, ethyl ether. (3-Methylphenyl) methanol, 1-methylpropyl ether. (3-Methylphenyl) methanol, isopropyl ether. (3-Methylphenyl) methanol, tert.-butyl ether. (4-Methylphenyl) methanol, neopentyl ether. (4-Methylphenyl) methanol, 2-methylpropyl ether. 3-Methylbenzyl acetate. .alpha.,.alpha.-Dimethoxy-m-xylene. 1-Propanol, 3-(phenylmethoxy)-.

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