Chlorprothixene

• Formula: C₁₈H₁₈ClS
• Molecular weight: 301.854
• IUPAC Standard InChI: InChI=1S/C18H18ClNS/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18/h3-4,6-10,12H,5,11H2,1-2H3/b14-7+ Copy

  
• IUPAC Standard InChIKey: WSPOMRSOLSGNFJ-VGOFMYFVSA-N Copy
• CAS Registry Number: 113-59-7
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
  The 3d structure may be viewed using Java or Javascript.
• Other names: 1-Propanamine, 3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethyl-, (Z)-; Thioxanthene-Δ9,γ-propylamine, 2-chloro-N,N-dimethyl-, (Z)-; α-Chlorprothixene; cis-Chlorprothixene; Chlorprothixen; Chlorprotixen; Chlorprotixene; Chlothixen; CPT; CPX; Iaractan; MK 184; N 714; Paxyl; Rentovet; Ro 4-0403; Tactaran; Taractan; Tarasan; Traquilan; Trictal; Truxal; Truxil; Vetacalm; (Z)-2-Chloro-N,N-dimethylthioxanthene-Δ9,γ-propylamine; Chloroprothixene; N 714C; Thioxanthene-Δ9, γ-propylamine, 2-chloro-N,N-dimethyl-; 2-Chloro-N,N-dimethylthioxanthene-Δ9,γ-propylamine; 2-Chloro-9-(3-(dimethylamino)propylidene)thioxanthene, (Z)-; cis-2-Chloro-9-(3-dimethylaminopropylidene)thioxanthene; Truxaletten; Chlorprothixine; 9H-Thioxanthene, 1-propanamine deriv.; Tardan; Ro-4-04033
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• Information on this page:
  • Phase change data
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Gas phase ion energetics data
  • IR Spectrum
  • Mass spectrum (electron ionization)
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Phase change data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing

Enthalpy of fusion

Entropy of fusion

Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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Van Den Dool and Kratz RI, non-polar column, temperature ramp

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Normal alkane RI, non-polar column, isothermal

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Normal alkane RI, non-polar column, temperature ramp

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Normal alkane RI, non-polar column, custom temperature program

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Chauvet and Masse, 1983
Chauvet, A.; Masse, J., Study of Pyschotherapeutic Substances II. Antipsycotic Substances. Chlorprothixene, Chlorpromazine Chlorohydrate, Levvomepromazine Chloro- hydrate, Fluphenazine Dichlorhydrate, Thermochim. Acta, 1983, 64, 267. [all data]

Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D., Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III, J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985 . [all data]

Chauvet and Masse, 1983, 2
Chauvet, A.; Masse, J., Etude thermoanalytique de substances psychotherapeutiques. II. Substances antipsychotiques. Chorprothixene, chlorhydrate de chlorpromazine, chlorhydrate de levomepromazine, dichlorhydrate de fluphenazine, Thermochim. Acta, 1983, 64, 267-284. [all data]

Masse and Chauvet, 1983
Masse, J.; Chauvet, A., Application of thermal analysis to the determination of the purity of chemical drugs. Chlorprothixene as an example, Ann. Pharm. Fr., 1983, 41, 6, 579. [all data]

Musumarra, Scarlata, et al., 1987
Musumarra, G.; Scarlata, G.; Romano, G.; Cappello, G.; Clementi, S.; Giulietti, G., Qualitative organic analysis. Part 2. Identification of drugs by principal components analysis of standardized TLC data in four eluent systems and of retention indices on SE 30, J. Anal. Toxicol., 1987, 11, 4, 154-163, https://doi.org/10.1093/jat/11.4.154 . [all data]

Oyama, Sano, et al., 1987
Oyama, N.; Sano, T.; Syoyama, M.; Maeda, K., Studies on systematic analysis of poisonous compounds in forensic chemistry. II. Application of capillary column gas chromatography to substance identification by means of retention indices, Eisei Kagaku, 1987, 33, 5, 342-348, https://doi.org/10.1248/jhs1956.33.342 . [all data]

Anderson and Stafford, 1983
Anderson, W.H.; Stafford, D.T., Applications of capillary gas chromatography in routine toxicological analyses, J. Hi. Res. Chromatogr. Chromatogr. Comm., 1983, 6, 5, 247-254, https://doi.org/10.1002/jhrc.1240060506 . [all data]

Dubsky, Hána, et al., 1978
Dubsky, H.; Hána, K.; Komárková, M.; Rittich, B., Pouzití kovatsovych indexu pri toxikologickych analysách, Chem. Listy, 1978, 72, 980-984. [all data]

MHA, 9999
MHA, Directorate of ForensicScience., Forensic Toxicology, 9999. [all data]

Maurer and Pfleger, 1984
Maurer, H.; Pfleger, K., Screening procedure for detection of phenothiazine and analogous neuroleptics and their metabolites in urine using a computerized gas chromatographic-mass spectrometric technique, J. Chromatogr., 1984, 306, 125-145, https://doi.org/10.1016/S0378-4347(00)80876-2 . [all data]

Marozzi, Gambaro, et al., 1982
Marozzi, E.; Gambaro, V.; Saligari, E.; Mariani, R.; Lodi, F., Use of the retention index in gas chromatographic studies of drugs, J. Anal. Toxicol., 1982, 6, 4, 185-192, https://doi.org/10.1093/jat/6.4.185 . [all data]

Ardrey and Moffat, 1981
Ardrey, R.E.; Moffat, A.C., Gas-liquid chromatographic retention indices of 1318 substances of toxicological interest on SE-30 or OV-1 stationary phase, J. Chromatogr., 1981, 220, 3, 195-252, https://doi.org/10.1016/S0021-9673(00)81925-1 . [all data]

Notes

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• Symbols used in this document:
  

  Tfus	Fusion (melting) point
  ΔfusH	Enthalpy of fusion
  ΔfusS	Entropy of fusion

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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