Home Other Building Blocks ETHYL 2-METHYL-2-(3-NITROPYRIDIN-2-YL)PROPANOATE

ETHYL 2-METHYL-2-(3-NITROPYRIDIN-2-YL)PROPANOATE

CAS No.:
154078-84-9
Catalog Number:
AG01DMAV
Molecular Formula:
C11H14N2O4
Molecular Weight:
238.2399
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Product Description
Catalog Number:
AG01DMAV
Chemical Name:
ETHYL 2-METHYL-2-(3-NITROPYRIDIN-2-YL)PROPANOATE
CAS Number:
154078-84-9
Molecular Formula:
C11H14N2O4
Molecular Weight:
238.2399
MDL Number:
MFCD16170977
IUPAC Name:
ethyl 2-methyl-2-(3-nitropyridin-2-yl)propanoate
InChI:
InChI=1S/C11H14N2O4/c1-4-17-10(14)11(2,3)9-8(13(15)16)6-5-7-12-9/h5-7H,4H2,1-3H3
InChI Key:
YEDHWTBDEHRYPG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1ncccc1[N+](=O)[O-])(C)C
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.095g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.243g/mol
Monoisotopic Mass:
238.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties