Chemical Properties of (4R,5S)-(+)-4-Methyl-5-phenyl-1,3-oxazolidine-2-thione (CAS 91794-28-4)

(4R,5S)-(+)-4-Methyl-5-phenyl-1,3-oxazolidine-2-thione

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InChI
InChI=1S/C10H11NOS/c1-7-9(12-10(13)11-7)8-5-3-2-4-6-8/h2-7,9H,1H3,(H,11,13)
InChI Key
KQSZLXCAZDPTNY-UHFFFAOYSA-N
Formula
C10H11NOS
SMILES
CC1N=C(S)OC1c1ccccc1
Molecular Weight1
193.26
CAS
91794-28-4
Sources

Physical Properties

Property Value Unit Source
Δf 254.95 kJ/mol Joback Calculated Property
Δfgas 50.70 kJ/mol Joback Calculated Property
Δfus 28.69 kJ/mol Joback Calculated Property
Δvap 58.49 kJ/mol Joback Calculated Property
logPoct/wat 2.43 Crippen Calculated Property
Pc 3796.32 kPa Joback Calculated Property
Tboil 613.14 K Joback Calculated Property
Tc 885.79 K Joback Calculated Property
Tfus 383.39 K Joback Calculated Property
Vc 0.54 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 366.62 J/mol×K 613.14 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 1
=CH- (ring) 5
=C< (ring) 2
-N= (ring) 1
-SH 1
-CH3 1
>CH- (ring) 2

Similar Compounds

3-Morpholinone, 5-methyl-6-phenyl-. 4(5H)-oxazolone, 2-amino-5-phenyl-. Phenmetrazine. Morpholine, 3-methyl-2-phenyl-, hydrochloride. Benzyl alcohol, alpha-[1-(dimethylamino)ethyl]-, acetate, hydrochloride. (4R,5s)-(+)-4-methyl-5-phenyl-2-oxazolidinone. Phendimetrazine. Acetamide, 1-acetoxy-1-phenyl-2-propyl-. Benzenemethanol, «alpha»-(1-aminoethyl)-. (-)-Norephedrine. Phenyl propanolamine hydrochloride. Norephedrine, (.+/-.)-. (1S,2R)-(+)-Norephedrine. Cathine. Morpholine, 3,4-dimethyl-2-phenyl-, d-, bitartrate.

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