Methyl 4-amino-2-ethoxy-5-nitrobenzoate

HCID 15096751
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Basic information

Standard SMILES
CCOc1cc(N)c([N+](=O)[O-])cc1C(=O)OC
InChIKey
IJFYCVWWJZYSKY-UHFFFAOYSA-N
Molecular formula
C10H12N2O5
Average molar mass
240.21 g/mol

Names & identifiers

Preferred name
Methyl 4-amino-2-ethoxy-5-nitrobenzoate
IUPAC
methyl 4-amino-2-ethoxy-5-nitrobenzoate

Names & synonyms

86718-17-4methyl 4-amino-2-ethoxy-5-nitrobenzoate4-Amino-2-ethoxy-5-nitrobenzoic Acid Methyl Esterstarbld0001697SCHEMBL9721456IJFYCVWWJZYSKY-UHFFFAOYSA-NDB-305469

Database identifiers

PubChem CID
15096751

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
107 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
17

Related reactions

8 records
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Compound notes

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