Chemical Properties of 3-F-4-CH3O-C6H3-CCH (CAS 120136-28-9)

3-F-4-CH3O-C6H3-CCH

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InChI
InChI=1S/C9H7FO/c1-3-7-4-5-9(11-2)8(10)6-7/h1,4-6H,2H3
InChI Key
PCQZNIONNPEWAZ-UHFFFAOYSA-N
Formula
C9H7FO
SMILES
C#Cc1ccc(OC)c(F)c1
Molecular Weight1
150.15
CAS
120136-28-9
Sources

Physical Properties

Property Value Unit Source
PAff 871.90 kJ/mol NIST
BasG 839.50 kJ/mol NIST
Δf 41.31 kJ/mol Joback Calculated Property
Δfgas -51.93 kJ/mol Joback Calculated Property
Δfus 19.57 kJ/mol Joback Calculated Property
Δvap 40.68 kJ/mol Joback Calculated Property
logPoct/wat 1.82 Crippen Calculated Property
Pc 3480.65 kPa Joback Calculated Property
Tboil 453.77 K Joback Calculated Property
Tc 666.17 K Joback Calculated Property
Tfus 312.44 K Joback Calculated Property
Vc 0.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 218.14 J/mol×K 453.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 1
=CH- (ring) 3
#C- 1
=C< (ring) 3
#CH 1
-CH3 1

Similar Compounds

2-Fluoro-4-methylanisole. 3-Fluoro-4-methoxyphenylacetonitrile. Amphetamine, 3'-fluoro-4'-methoxy. 3-Fluoro-4-methoxyphenylacetic acid. Acetophenone, 3'-fluoro-4'-methoxy-. 4-CH3O-C6H4-CCH. 2-Fluoroanisole. Benzene, 1-ethoxy-2-fluoro-. 4-Fluoro-2-methylanisole. 2-Fluoro-4-(trifluoromethyl)phenol. 2,4-Difluoroanisole. 3-(3-Fluoro-4-methoxybenzoyl)propionic acid. 2,5-Dimethoxyfluorobenzene. 3-Cl-4-CH3O-C6H3-CCH. 4-Fluoro-3-methylanisole.

Find more compounds similar to 3-F-4-CH3O-C6H3-CCH.

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