Chemical Properties of Benperidol (CAS 2062-84-2)

Benperidol

InChI
InChI=1S/C22H24FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-10,18H,3,6,11-15H2,(H,24,28)
InChI Key
FEBOTPHFXYHVPL-UHFFFAOYSA-N
Formula
C22H24FN3O2
SMILES
O=C(CCCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(F)cc1
Molecular Weight1
381.44
CAS
2062-84-2
Other Names
  • 1-1-(3-(p-Fluorobenzoyl)propyl)-4-piperidyl-2-benzimidazolinone
  • 1-[1-[4-(4-Fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one
  • 2-Benzimidazolinone, 1-[1-[3-(p-fluorobenzoyl)propyl]-4-piperidyl]-
  • 2H-Benzimidazol-2-one, 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1,3-dihydro-
  • 8089 C. B.
  • Anquil
  • Benzoperidol
  • Benzperidol
  • CB 8089
  • Concilium
  • Frenactil
  • Frenactyl
  • Glianimon
  • Glianimon mite
  • McN-JR-4584
  • R 4584
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Physical Properties

Property Value Unit Source
ω 0.9474 Relay (1.0) Calculated Property
ΔfG° 196.42 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -353.71 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 176.72 kJ/mol Relay (1.0) Calculated Property
IE 7.73 eV Relay (1.0) Calculated Property
log10WS -4.28 Rytting (2005)
logPoct/wat 4.181 Crippen Calculated Property
McVol 286.450 ml/mol McGowan Calculated Property
Pc 1808.85 kPa Relay (1.0-beta) Calculated Property
Tboil 728.97 K Relay (1.0) Calculated Property
Tc 1078.79 K Relay (1.0) Calculated Property
Tfus 506.05 K Relay (1.0) Calculated Property
Vc 1.046 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. 2-Dimethylamino-8(ar)-methoxy-tetrahydro-1-acenaphthone. Zinc octaethylporphyrin chloride. Tazettine. Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 2-Piperidinomethyl-8(ar)-methoxy-tetrahydro-1-acenaphthone. AJMALINE, M(DIHYDRO-), AC. 9H-purine-6(1h)-thione, 2-amino-9-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine. Codeine-propionyl. Ajmaline.

Find more compounds similar to Benperidol.

Sources

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