3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid


Chemical Name: 3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid
CAS Number: 232595-59-4
Product Number: AG002MON(AGN-PC-01UBYG)
Synonyms:
MDL No: MFCD02682202
Molecular Formula: C12H15NO5
Molecular Weight: 253.2512

Identification/Properties


Properties
MP:
150℃
BP:
395.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
253.254g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
253.095g/mol
Monoisotopic Mass:
253.095g/mol
Topological Polar Surface Area:
95.9A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
323
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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