Chemical Properties of Histidine (CAS 71-00-1)

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

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• S_Prot : Protonation entropy at 298K (J/mol×K).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
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
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
log10WS	-0.53		Aq. Sol...
logPoct/wat	-1.118		Crippen Calculated Property
McVol	113.320	ml/mol	McGowan Calculated Property

Temperature Dependent Properties

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

• 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

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