Methyl 2'-methyl-2-nitro-1,1'-biphenyl-4-carboxylate

HCID 59606541
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Basic information

Standard SMILES
COC(=O)c1ccc(-c2ccccc2C)c([N+](=O)[O-])c1
InChIKey
RRGGCUPDEFQEFM-UHFFFAOYSA-N
Molecular formula
C15H13NO4
Average molar mass
271.27 g/mol
Monoisotopic mass
271.0844579

Names & identifiers

Preferred name
Methyl 2'-methyl-2-nitro-1,1'-biphenyl-4-carboxylate
IUPAC
methyl 4-(2-methylphenyl)-3-nitrobenzoate

Names & synonyms

SCHEMBL2773008RRGGCUPDEFQEFM-UHFFFAOYSA-Nmethyl 2'-methyl-2-nitro-1,1'-biphenyl-4-carboxylate

Database identifiers

PubChem CID
59606541

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
72.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

Related reactions

6 records
New reaction record

Compound notes

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Methyl 2'-methyl-2-nitro-1,1'-biphenyl-4-carboxylate (HCID 59606541)｜Huagongshe