- InChI
- InChI=1S/C17H13N3O5S2/c21-15(13-3-1-2-4-14(13)16(22)23)19-11-5-7-12(8-6-11)27(24,25)20-17-18-9-10-26-17/h1-10H,(H,18,20)(H,19,21)(H,22,23)
- InChI Key
- PBMSWVPMRUJMPE-UHFFFAOYSA-N
- Formula
- C17H13N3O5S2
- SMILES
-
O=C(O)c1ccccc1C(=O)Nc1ccc(S(=O
)(=O)Nc2nccs2)cc1 - Molecular Weight1
- 403.43
- CAS
- 85-73-4
- Other Names
-
- 4'-(2-Thiazolylsulfamyl)phthalanilic acid
- Benzoic acid, 2-[[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]carbonyl]-
- (o-Carboxybenzoyl)-p-aminophenylsulfonamidothiazole
- AFI-Ftalyl
- Cremothalidine
- Enteramida
- Entero-sulfina
- Entexidina
- Ftalazol
- Ftalil-Esteve
- Ftalil-Septol
- Ftalysept
- Intestiazol
- Phtalazol
- Phthalanilic acid, 4'-(2-thiazolylsulfamoyl)-
- Phthalazol
- Phthalazole
- Phthalidin
- Phthaloylsulfathiazole
- Phthalylnorsulfazole
- Phthalylsulfonazole
- Sulfacetil
- Sulfanilamide, N4-(o-carboxybenzoyl)-N'-2-thiazolyl-
- Sulfaphthalazole
- Sulfathalidine
- Sulftalyl
- Sulphaphthalyl
- Taleudron
- Talidine
- Taloudron
- Thalazole
- Thalinil
- Thalistanin
- Thalistatyl
- Ultratiazol
- 2-(p-N-Phthalylsulfanilyl)aminothiazole
- 2-(p-Phthalylaminobenzenesulfamido)thiazole
- 2-(N4-phthalylaminobenzenesulfonamido)thiazole
- 2-(N4-phthalylsulfanilamido)thiazole
- 2-(N4-Phthalylaminobenzenesulfonamide)thiazole
- 4'-(2-Thiazolylsulfamoyl)phthalanilic acid
- Ftalylsulfathiazol
- Phthalylsulphathiazole
- NSC 66454
- NSC 683525
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.0776 | Relay (... Calculated Property | |
| ΔfG° | -91.56 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -464.05 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 165.74 | kJ/mol | Relay (... Calculated Property |
| IE | 8.29 | eV | Relay (... Calculated Property |
| log10WS | -3.61 | Relay (... Calculated Property | |
| logPoct/wat | 2.894 | Crippen Calculated Property | |
| McVol | 266.800 | ml/mol | McGowan Calculated Property |
| Pc | 3686.83 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 743.76 | K | Relay (... Calculated Property |
| Tc | 1222.96 | K | Relay (... Calculated Property |
| Tfus | 544.16 | K | Relay (... Calculated Property |
| Vc | 0.915 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Phthalylsulfathiazole.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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