Methyl 6-(2-nitro-5-methoxyphenoxy)hexanoate

HCID 22007142
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Basic information

Standard SMILES
COC(=O)CCCCCOc1cc(OC)ccc1[N+](=O)[O-]
InChIKey
GBFLQXYLCMXUEO-UHFFFAOYSA-N
Molecular formula
C14H19NO6
Average molar mass
297.3 g/mol
Monoisotopic mass
297.12123733

Names & identifiers

Preferred name
Methyl 6-(2-nitro-5-methoxyphenoxy)hexanoate
IUPAC
methyl 6-(5-methoxy-2-nitrophenoxy)hexanoate

Names & synonyms

SCHEMBL7913973GBFLQXYLCMXUEO-UHFFFAOYSA-Nmethyl 6-(2-nitro-5-methoxyphenoxy)hexanoate

Database identifiers

PubChem CID
22007142

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
90.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
21

Related reactions

3 records
New reaction record

Compound notes

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