- InChI
- InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m1/s1
- InChI Key
- HNDVDQJCIGZPNO-RXMQYKEDSA-N
- Formula
- C6H9N3O2
- SMILES
- NC(Cc1c[nH]cn1)C(=O)O
- Molecular Weight1
- 155.15
- CAS
- 71-00-1
- Other Names
-
- (S)-.alpha.-amino-1H-imidazole-4-propanoic acid
- (S)-4-(2-amino-2-carboxyethyl)imidazole
- (S)-histidine
- 1H-Imidazole-4-propanoic acid, «alpha»-amino-, (S)-
- 1H-Imidazole-4-propanoic acid, «alpha»-amino-, (S)-
- 4-(2-Amino-2-carboxyethyl)imidazole
- Anti-rheuma
- D-histidine
- Glyoxaline-5-alanine
- Histidine, L-
- L-(-)-Histidine
- L-Histidine
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- SProt : Protonation entropy at 298K (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (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 | 0.7328 | Relay (1.0) Calculated Property | |
| PAff | [979.10; 996.00] | kJ/mol |
|
| PAff | 988.00 | kJ/mol | NIST |
| PAff | 996.00 ± 2.80 | kJ/mol | NIST |
| PAff | 988.40 ± 5.40 | kJ/mol | NIST |
| PAff | 979.10 | kJ/mol | NIST |
| BasG | [941.10; 952.60] | kJ/mol |
|
| BasG | 950.20 | kJ/mol | NIST |
| BasG | 952.60 ± 3.20 | kJ/mol | NIST |
| BasG | 941.10 ± 5.40 | kJ/mol | NIST |
| ΔcH°solid | [-3205.50; -3180.60] | kJ/mol |
|
| ΔcH°solid | -3205.50 ± 2.50 | kJ/mol | NIST |
| ΔcH°solid | -3180.60 ± 2.30 | kJ/mol | NIST |
| SProt | -37.00 ± 5.00 | J/mol×K | NIST |
| ΔfG° | -57.25 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -251.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | [-466.70; -441.80] | kJ/mol |
|
| ΔfH°solid | -441.80 ± 2.60 | kJ/mol | NIST |
| ΔfH°solid | -466.70 ± 2.80 | kJ/mol | NIST |
| ΔvapH° | 100.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.59 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.53 | Aq. Solubility Prediction | |
| logPoct/wat | -1.118 | Crippen Calculated Property | |
| McVol | 113.320 | ml/mol | McGowan Calculated Property |
| Pc | 4960.63 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 588.58 | K | Relay (1.0) Calculated Property |
| Tc | 853.80 | K | Relay (1.0) Calculated Property |
| Tfus | 552.45 | K | Relay (1.0) Calculated Property |
| Vc | 0.395 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔsubH | 142.00 ± 8.00 | kJ/mol | 442.00 | NIST |
Similar Compounds
Find more compounds similar to Histidine.
Mixtures
- Histidine + Water
- Lactic acid + Histidine + Water
- Histidine + Acetic acid, sodium salt + Water
- Acetic acid, calcium salt + Histidine + Water
- potassium chloride + Histidine + Water
- Potassium nitrate + Histidine + Water
- sodium chloride + Histidine + Water
- Dimethyl Sulfoxide + Histidine + Water
- Glucose + Histidine + Water
- Acetone + Histidine + Water
- Ethanol + Histidine + Water
- Isopropyl Alcohol + Histidine + Water
- Ethanol + Histidine
- Histidine + Methyl Alcohol
- 1-Propanol + Histidine
- Isopropyl Alcohol + Histidine
- 1-Butanol + Histidine
- 1-Propanol, 2-methyl- + Histidine
- Dimethyl Sulfoxide + Histidine
- Formamide, N,N-dimethyl- + Histidine
Find more mixtures with Histidine.
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
- Viscosities of L-Histidine/L-Glutamic Acid/L-Tryptophan/Glycylglycine+2 M Aqueous KCl/KNO3 Solutions at T =(298.15 to 323.15)K
- Viscosity Behavior of alpha-Amino Acids in Acetate Salt Solutions at Temperatures (303.15 to 323.15) K
- Surface tension and UV-visible investigations of aggregation and adsorption behavior of NaC and NaDC in water-amino acid mixtures
- Modeling solubility and acid-base properties of some polar side chain amino acids in NaCl and (CH3)4NCl aqueous solutions at different ionic strengths and temperatures
- Partial molar volumes of L-alanine, DL-serine, DL-threonine, L-histidine, glycine, and glycylglycine in water, NaCl, and DMSO aqueous solutions at T = 298.15 K
- Volumetric, ultrasonic, and viscometric behaviour of l-histidine in aqueous-glucose solutions at different temperatures
- Interactions in (L-phenylalanine/L-histidine + 0.01 mol kg-1 aqueous beta-cyclodextrin) systems at T = (293.15, 298.15, 303.15 and 308.15) K
- Effect of temperature and additives on the critical micelle concentration and thermodynamics of micelle formation of sodium dodecyl benzene sulfonate and dodecyltrimethylammonium bromide in aqueous solution: A conductometric study
- Conductivity and fluorescence studies on the micellization properties of sodium cholate and sodium deoxycholate in aqueous medium at different temperatures: Effect of selected amino acids
- Solubility of L-histidine in different aqueous binary solvent mixtures from 283.15 K to 318.15 K with experimental measurement and thermodynamic modelling
- Structure making behaviour of L-histidine in aqueous solutions of ampicillin sodium at different temperatures: Using physicochemical methods
- APPARENT MOLAR VOLUME, COMPRESSIBILITY AND VISCOMETRIC STUDIES OF SODIUM DODECYL BENZENE SULFONATE (SDBS) AND DODECYLTRIMETHYLAMMONIUM BROMIDE (DTAB) IN AQUEOUS AMINO ACID SOLUTIONS: A THERMO-ACOUSTIC APPROACH
- Volumetric, compressibility and viscometric studies on sodium cholate/sodium deoxycholate amino acid interactions in aqueous medium
- Intermolecular Interactions of L-glutamine and L-histidine in Aqueous Solutions of Metformin hydrochloride: Volumetric, Compressibility and Viscometric Studies
- Solubility of the Proteinogenic a-Amino Acids in Water, Ethanol, and Ethanol-Water Mixtures
- Synthesis and Physical and Thermodynamic Properties of Lactic Acid and Malic Acid-Based Natural Deep Eutectic Solvents
- Determination and Modeling of d-Histidine Solubility in Several Pure Solvents from 293.15 to 333.15 K
- Temperature of Maximum Density for Binary Aqueous Solutions of Five Amino Acids
- Volumetric Behavior on Interactions of a-Amino Acids with Sodium Acetate, Potassium Acetate, and Calcium Acetate in Aqueous Solutions
- Ultrasonic Velocities and Densities of l-Histidine or l-Glutamic Acid or l-Tryptophan or Glycylglycine + 2 mol*L-1 Aqueous KCl or KNO3 Solutions from (298.15 to 323.15) K
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.