Asparagine (data page)

Asparagine (data page)

OrganicBox complete
wiki_name=Asparagine
name=(2S)-2-amino-3-carbamoyl-propanoic acid
= GENERAL INFORMATION =

C=4 |H=8 |N=2 |O=3
mass=132.118
abbreviation=N, Asn


synonyms=(S)-2-aminosuccinic acid 4-amide
{α/2}-aminosuccinamic acid
Agedoite
Altheine
Asparagine acid
Asparamide
Asparatamine
Aspartamic acid
Aspartamine
Aspartic acid β-amide
Aspartic acid amide
CHEBI:17196
Crystal VI
NSC 82391

= DATABASES =

SMILES=C( [C@@H] (C(=O)O)N)C(=O)N
InChI=1/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1/f/h8H,6H2
CAS= [70-47-3]
DrugBank=
EINECS=200-735-9
PubChem=6267 (L) ref_N|1|a
= PHYSICAL PROPERTIES =

--------------- Structure -------------
index_of_refraction=
abbe_number=
dielectric_constant=
magnetic_susceptibility=
dipole_moment=
------------- U-V data --------------
lambda_max=
extinction_coefficient=
------------- Infrared data --------------
absorption_bands=
------------- NMR data --------------
proton_NMR=
carbon_NMR=
other_NMR=
------------- Spectrometry data --------------
mass_spectrometry=
-------- Phase behaviour -------
delta_fus_H_o=
delta_fus_S_o=
delta_vap_H_o=
delta_vap_S_o=
triple_point_K=
triple_point_C=
triple_point_Pa=
criticle_point_K=
criticle_point_C=
criticle_point_Pa=
------- Solid properties -------
delta_f_H_o_solid=
S_o_solid=
heat_capacity_solid=
density_solid=
melting_point_C=235
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=-3.952
isoelectric_point=5.41
disociation_constant=2.16; 8.73
tautomers=2
H_bond_donor=3
H_bond_acceptor=4
= PHARMACOLOGICAL PROPERTIES =

References

#note_N|1|a PubChemLink|6267 (L-asparagine)


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