Home Other Building Blocks ETHYL 3,5-DINITROBENZOATE

ETHYL 3,5-DINITROBENZOATE

CAS No.:
618-71-3
Catalog Number:
AG003Q6U
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003Q6U
Chemical Name:
ETHYL 3,5-DINITROBENZOATE
CAS Number:
618-71-3
MDL Number:
MFCD00007232
IUPAC Name:
ethyl 3,5-dinitrobenzoate
InChI:
InChI=1S/C9H8N2O6/c1-2-17-9(12)6-3-7(10(13)14)5-8(4-6)11(15)16/h3-5H,2H2,1H3
InChI Key:
IBQREHJPMPCXQA-UHFFFAOYSA-N
EC Number:
210-559-4
NSC Number:
32741
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.038g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.171g/mol
Monoisotopic Mass:
240.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties