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2-(1-Oxo-5-phenoxypentyl)-4-methylphenyl diethylcarbamate

HCID 54526723
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCN(CC)C(=O)Oc1ccc(C)cc1C(=O)CCCCOc1ccccc1
InChIKey
YTQFTJBJLONXLB-UHFFFAOYSA-N
Molecular formula
C23H29NO4
Average molar mass
383.5 g/mol

Names & identifiers

Preferred name
2-(1-Oxo-5-phenoxypentyl)-4-methylphenyl diethylcarbamate
IUPAC
[4-methyl-2-(5-phenoxypentanoyl)phenyl] N,N-diethylcarbamate

Names & synonyms

SCHEMBL8945646YTQFTJBJLONXLB-UHFFFAOYSA-N2-(1-Oxo-5-phenoxypentyl)-4-methylphenyl diethylcarbamate

Database identifiers

PubChem CID
54526723

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
28
Formal charge
0
Complexity
471

Related reactions

1 records
New reaction record
HRID 1721383 reaction equation
HRID 1721383As productuspto-grants-1996_04

Compound notes

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