Benzaldehyde, 4-hydroxy-3-methoxy-5-nitro-


Chemical Name: Benzaldehyde, 4-hydroxy-3-methoxy-5-nitro-
CAS Number: 6635-20-7
Product Number: AG003LHT(AGN-PC-0JLT1T)
Synonyms:
MDL No:
Molecular Formula: C8H7NO5
Molecular Weight: 197.1449

Identification/Properties


Properties
MP:
172-175 °C(lit.)
BP:
320.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Air Sensitive
Refractive Index:
1.5700 (estimate)
Computed Properties
Molecular Weight:
197.146g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
197.032g/mol
Monoisotopic Mass:
197.032g/mol
Topological Polar Surface Area:
92.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
226
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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