Chemical Properties of Sulfathiazole (CAS 72-14-0)

InChI

InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)

InChI Key

JNMRHUJNCSQMMB-UHFFFAOYSA-N

Formula

C9H9N3O2S2

SMILES

Nc1ccc(S(=O)(=O)Nc2nccs2)cc1

Molecular Weight¹

255.32

CAS

72-14-0

Other Names

• 2-(Sulfanilylamino)thiazole
• 2-(p-Aminobenzenesulfonamido)thiazole
• 2-(p-Aminobenzenesulphonamido)thiazole
• 2-Sulfanilamidothiazol
• 2-Sulfanilamidothiazole
• 2-Sulfathiazole
• 2090 R.P.
• 4-Amino-N-2-thiazolylbenzenesulfonamide
• 4-Amino-N-2-thiazolylbenzenesulfonamide (sulfathiazole)
• 4-[(1,3-Thiazol-2-yl)aminosulfonyl]aniline
• Azoquimiol
• Azoseptale
• Benzenesulfonamide, 4-amino-N-2-thiazolyl-
• Cerazol
• Cerazol (suspension)
• Cerazole
• Chemosept
• Ciba 3714
• Cibazol
• Coco-Thiazole
• Duatok
• Dulana
• Eleudron
• Enterobiocine
• Estafilol
• Formosulfathiazole
• M&B 760
• M+B 760
• N'-(2-Thiazolyl)sulfanilamide
• N(Sup1)-(2-Thiazolyl)sulfanilamide
• N-(2-thiazolyl)sulfanilamide
• N-1-2-Thiazolylsulfanilamide
• Neostrepsan
• Norsulfasol
• Norsulfazole
• Planomide
• Poliseptil
• RP 2090
• Sanotiazol
• Septozol
• Streptosilthiazole
• Sulfamul
• Sulfanilamide, N(sup1)-2-thiazolyl-
• Sulfanilamide, N1-2-thiazolyl-
• Sulfanilamide, N1-4-thiazolin-2-ylidene-
• Sulfanilamidothiazole
• Sulfathiazol
• Sulfavitina
• Sulfocerol
• Sulphathiazole
• Sulzol
• Thiacoccine
• Thiasulfol
• Thiazamide
• Thiozamide
• USAF SN-9
• Wintrazole

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.6830		Relay (1.0) Calculated Property
ΔfG°	140.23	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-75.72	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	115.58	kJ/mol	Relay (1.0) Calculated Property
IE	7.90	eV	Relay (1.0) Calculated Property
log10WS	-2.69		Aq. Solubility Prediction
logPoct/wat	1.526		Crippen Calculated Property
McVol	168.830	ml/mol	McGowan Calculated Property
Pc	4272.08	kPa	Relay (1.0-beta) Calculated Property
Tboil	665.65	K	Relay (1.0) Calculated Property
Tc	1009.01	K	Relay (1.0) Calculated Property
Tfus	[437.00; 474.70]	K
Tfus	473.40 ± 1.00	K	NIST
Tfus	437.00 ± 0.50	K	NIST
Tfus	474.70 ± 0.50	K	NIST
Vc	0.581	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to Sulfathiazole.

Mixtures

• cyclohexapentylose + Sulfathiazole + Water
• Sulfathiazole + Water

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
• Effect of presence of alpha-cyclodextrin and beta-cyclodextrin on solution behavior of sulfathiazole at different temperatures: Thermodynamic and spectroscopic studies
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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