Benzoic acid, 4-methyl-3,5-dinitro-, methyl ester


Chemical Name: Benzoic acid, 4-methyl-3,5-dinitro-, methyl ester
CAS Number: 49592-71-4
Product Number: AG003RVY(AGN-PC-0L9WBP)
Synonyms:
MDL No: MFCD00451040
Molecular Formula: C9H8N2O6
Molecular Weight: 240.1696

Identification/Properties


Properties
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
240.171g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
240.038g/mol
Monoisotopic Mass:
240.038g/mol
Topological Polar Surface Area:
118A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
309
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


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback