Home Nitros ethyl 2-nitro-2-(3-oxocyclohexyl)acetate

ethyl 2-nitro-2-(3-oxocyclohexyl)acetate

CAS No.:
1353763-37-7
Catalog Number:
AG01BG1F
Molecular Formula:
C10H15NO5
Molecular Weight:
229.2298
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Product Description
Catalog Number:
AG01BG1F
Chemical Name:
ethyl 2-nitro-2-(3-oxocyclohexyl)acetate
CAS Number:
1353763-37-7
Molecular Formula:
C10H15NO5
Molecular Weight:
229.2298
MDL Number:
MFCD28139375
IUPAC Name:
ethyl 2-nitro-2-(3-oxocyclohexyl)acetate
InChI:
InChI=1S/C10H15NO5/c1-2-16-10(13)9(11(14)15)7-4-3-5-8(12)6-7/h7,9H,2-6H2,1H3
InChI Key:
FCQZCZJUXQLWPL-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C1CCCC(=O)C1)[N+](=O)[O-]
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.095g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.232g/mol
Monoisotopic Mass:
229.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
89.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties