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Home > Nitro Compounds > 116059-07-5
116059-07-5 | Glycine, N-methyl-N-(2-nitrophenyl)-, ethyl ester
CAS No: 116059-07-5 Catalog No: AG00HDOS MDL No:MFCD01604421
Product Description
Catalog Number:
AG00HDOS
Chemical Name:
Glycine, N-methyl-N-(2-nitrophenyl)-, ethyl ester
CAS Number:
116059-07-5
Molecular Formula:
C11H14N2O4
Molecular Weight:
238.2399
MDL Number:
MFCD01604421
IUPAC Name:
ethyl 2-(N-methyl-2-nitroanilino)acetate
InChI:
InChI=1S/C11H14N2O4/c1-3-17-11(14)8-12(2)9-6-4-5-7-10(9)13(15)16/h4-7H,3,8H2,1-2H3
InChI Key:
OCZWLFVQSNPXBF-UHFFFAOYSA-N
SMILES:
CCOC(=O)CN(c1ccccc1[N+](=O)[O-])C
Properties
Complexity:
277
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:
5
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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