Phenol, 2-methoxy-5-nitro-


Chemical Name: Phenol, 2-methoxy-5-nitro-
CAS Number: 636-93-1
Product Number: AG003HJD(AGN-PC-0JL91O)
Synonyms:
MDL No:
Molecular Formula: C7H7NO4
Molecular Weight: 169.1348

Identification/Properties


Properties
MP:
103-107 °C(lit.)
BP:
291°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5830 (rough estimate)
Computed Properties
Molecular Weight:
169.136g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
169.038g/mol
Monoisotopic Mass:
169.038g/mol
Topological Polar Surface Area:
75.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
167
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:
H302-H315-H319-H335-H412
Precautionary Statements:
P261-P273-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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