Threonine (data page)

OrganicBox complete
-------------- GENERAL ----------------
wiki_name=Threonine


name=(2S,3R)-2-Amino-3-hydroxybutanoic acid
C=4 |H=9 |N=1 |O=3
mass=119.12
abbreviation=T, Thr
synonyms=
--------------DATABASES ----------------
SMILES=CC(O)C(N)C(=O)O
InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1/f/h7H
CAS=72-19-5
DrugBank=
EINECS=200-774-1 ref_N|1|a
PubChem=69435 (D) ref_N|2|a, 6288 (L) ref_N|3|a
-------- Structure and properties -------
index_of_refraction=
abbe_number=
dielectric_constant=
magnetic_susceptibility=
-------------- Spectral data --------------
lambda_max=
extinction_coefficient=
absorption_bands=
proton_NMR=
carbon_NMR=
other_NMR=
mass_spectrometry=
-------- Phase behaviour -------
triple_point_K=
triple_point_C=
triple_point_Pa=
criticle_point_K=
criticle_point_C=
criticle_point_Pa=
delta_fus_H_o=
delta_fus_S_o=
delta_vap_H_o=
delta_vap_S_o=
------- Solid properties -------
delta_f_H_o=
S_o_solid=
heat_capacity_solid=
density_solid=
melting_point_C=256
melting_point_F=
melting_point_K=
------- Liquid properties -------
delta_f_H_o_liquid=
S_o_liquid=
heat_capacity_liquid=
density_liquid=
viscosity_liquid=
boiling_point_C=
boiling_point_F=
boiling_point_K=
------------- Gas properties --------------
delta_f_H_o_gas=
S_o_gas=
heat_capacity_gas=
viscosity_gas=
= HAZARD PROPERTIES =

MSDS=
main_hazards=
nfpa_health=
nfpa_flammability=
nfpa_reactivity=
nfpa_special=
flash_point=
r_phrases=
s_phrases=
RTECS_number=
= CHEMICAL PROPERTIES =

XLogP=-3.036
isoelectric_point=5.60
disociation_constant=2.20, 8.96
tautomers=
H_bond_donor=3
H_bond_acceptor=4

References

#note_N|1|a EINECSLink|200-774-1 (Threonine)
#note_N|2|a PubChemLink|69435 (D-Threonine)
#note_N|3|a PubChemLink|6288 (L-Threonine)