N-(4-Methyl-2-nitrophenyl)glycine

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Basic information

CAS: 62573-36-8
Standard SMILES: Cc1ccc(NCC(=O)O)c([N+](=O)[O-])c1
InChIKey: STDUAJYOFXORNK-UHFFFAOYSA-N
Molecular formula: C9H10N2O4
Average molar mass: 210.19 g/mol
Monoisotopic mass: 210.0640568

Names & identifiers

Preferred name: N-(4-Methyl-2-nitrophenyl)glycine
IUPAC: 2-(4-methyl-2-nitroanilino)acetic acid

Names & synonyms

n-(4-methyl-2-nitrophenyl)glycine62573-36-8DTXSID50303538N-[4-Methyl-2-nitrophenyl]glycineRefChem:362120DTXCID30254670NSC158989SCHEMBL11463783STDUAJYOFXORNK-UHFFFAOYSA-NGlycine,n-(4-methyl-2-nitrophenyl)-NSC-158989(4-Methyl-2-nitroanilino)acetic acid #

Show more names

DS-001898

Database identifiers

CAS: 62573-36-8
PubChem CID: 292822
DTXSID: DTXSID50303538

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 95.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 251

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Compound notes

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