methyl 2-amino-5-methyl-3-nitrobenzoate


Chemical Name: methyl 2-amino-5-methyl-3-nitrobenzoate
CAS Number: 1248541-72-1
Product Number: AG000MSS(AGN-PC-0C8TXY)
Synonyms:
MDL No:
Molecular Formula: C9H10N2O4
Molecular Weight: 210.1867

Identification/Properties


Computed Properties
Molecular Weight:
210.189g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
210.064g/mol
Monoisotopic Mass:
210.064g/mol
Topological Polar Surface Area:
98.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
263
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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