Chemical Properties of 1-Phenyl-2-acetyl-4-methyl-3-pyrazolidone (CAS 2655-48-3)

1-Phenyl-2-acetyl-4-methyl-3-pyrazolidone

InChI
InChI=1S/C12H14N2O2/c1-9-8-13(11-6-4-3-5-7-11)14(10(2)15)12(9)16/h3-7,9H,8H2,1-2H3
InChI Key
BPNPRBBKUKZUCD-UHFFFAOYSA-N
Formula
C12H14N2O2
SMILES
CC(=O)N1C(=O)C(C)CN1c1ccccc1
Molecular Weight1
218.25
CAS
2655-48-3
Other Names
  • 2-acetyl-4-methyl-1-phenylpyrazolidin-3-one
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Physical Properties

Property Value Unit Source
ω 0.5458 Relay (1.0) Calculated Property
ΔfG° 69.28 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -157.86 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 80.26 kJ/mol Relay (1.0) Calculated Property
IE 7.95 eV Relay (1.0) Calculated Property
log10WS -1.94 Relay (1.0) Calculated Property
logPoct/wat 1.433 Crippen Calculated Property
McVol 168.420 ml/mol McGowan Calculated Property
Pc 2780.44 kPa Relay (1.0-beta) Calculated Property
Tboil 581.32 K Relay (1.0) Calculated Property
Tc 835.52 K Relay (1.0) Calculated Property
Tfus 366.98 K Relay (1.0) Calculated Property
Vc 0.608 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

1-Phenyl-2-acetyl-4,4-dimethyl-3-pyrazolidone. 1-Phenyl-2-acetyl-3-pyrazolidone. 5,6-Dihydrouracil riboside, TMS. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Tazettine. Zinc octaethylporphyrin chloride. DILTIAZEM, M(ODESMETHYL-), AC. Dehydrocytisine. Diltiazem. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Thebacon. Prajmaline. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). TCN.

Find more compounds similar to 1-Phenyl-2-acetyl-4-methyl-3-pyrazolidone.

Sources

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