4-pyridoxic acid


Chemical Name: 4-pyridoxic acid
CAS Number: 82-82-6
Product Number: AG003M0M(AGN-PC-0WAJFP)
Synonyms:
MDL No:
Molecular Formula: C8H9NO4
Molecular Weight: 183.1614

Identification/Properties


Properties
MP:
>233°C (dec.)
BP:
584.5°C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
183.163g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
183.053g/mol
Monoisotopic Mass:
183.053g/mol
Topological Polar Surface Area:
90.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
197
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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