Glycine, N-(m-nitrophenyl)-, ethyl ester
Basic information
- CAS
3589-58-0- Standard SMILES
CCOC(=O)CNc1cccc([N+](=O)[O-])c1- InChIKey
FOBXNGRQPJUTNJ-UHFFFAOYSA-N- Molecular formula
- C10H12N2O4
- Average molar mass
- 224.21 g/mol
- Monoisotopic mass
- 224.07970686
Names & identifiers
- Preferred name
- Glycine, N-(m-nitrophenyl)-, ethyl ester
- IUPAC
- ethyl 2-(3-nitroanilino)acetate
Names & synonyms
3589-58-0GLYCINE, N-(m-NITROPHENYL)-, ETHYL ESTERDTXSID20189447RefChem:1086042DTXCID50111938Ethyl N-(m-nitrophenyl)glycinateethyl {3-nitroanilino}acetateethyl2-(3-nitroanilino)acetateethyl 2-(3-nitroanilino)acetateBRN 2811849Glycine, N-(3-nitrophenyl)-, ethyl esterN-(m-Nitrophenyl)glycine ethyl ester
Show more names
ethyl 2-((3-nitrophenyl)amino)acetateethyl 3-nitrophenylglycinateSCHEMBL641425Ethyl N-(3-nitrophenyl)glycinateFOBXNGRQPJUTNJ-UHFFFAOYSA-Nphenylglycine, m-nitro- ethyl ester-AKOS009135988(3-nitro-phenylamino)-acetic acid ethyl ester
Database identifiers
- CAS
3589-58-0- PubChem CID
- 19172
- DTXSID
DTXSID20189447- Nikkaji
- J127.641G
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 252
Related reactions
3 records
Compound notes
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