Chemical Properties of 3-Acetyl-2-methyl-5-phenylthiophene (CAS 40932-63-6)

3-Acetyl-2-methyl-5-phenylthiophene

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InChI
InChI=1S/C13H12OS/c1-9(14)12-8-13(15-10(12)2)11-6-4-3-5-7-11/h3-8H,1-2H3
InChI Key
GREAZYFTAJMZFD-UHFFFAOYSA-N
Formula
C13H12OS
SMILES
CC(=O)c1cc(-c2ccccc2)sc1C
Molecular Weight1
216.30
CAS
40932-63-6
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Physical Properties

Property Value Unit Source
ΔsubH° 108.90 ± 0.40 kJ/mol NIST
log10WS -4.97 Crippen Calculated Property
logPoct/wat 3.926 Crippen Calculated Property
McVol 168.730 ml/mol McGowan Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔsubH 107.30 ± 0.40 kJ/mol 330.00 NIST

Similar Compounds

cannabinolic acid, methyl-boronate. cannabinolic acid, n-butyl-boronate. 16A-Hydroxyoestrone, TMS. propyl-cannabinolic acid, n-butyl-boronate. propyl-cannabinolic acid, methyl-boronate. Mirtazapine-M (HO-) AC. Mirtazapine-M (nor-HO-methoxy-) 2AC. Mirtazapine-M (nor-HO-) 2AC. 11-Dehydroestradiol, TMS. 5-Methoxytryptophan, ethoxycarbonylated, TBDMS. 17A-11-Dehydroestradiol, TMS. 5-Hydroxytryptophan, ethoxycarbonylated, TBDMS # 1. cannabidiolic acid, methyl-boronate. Iprindole. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate.

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