2-{N,N-di(2-ethylhexyl)carbamoyl}-benzoic acid

HCID 20147052
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCC(CC)CN(CC(CC)CCCC)C(=O)c1ccccc1C(=O)O
InChIKey
GHJHOPDCAVDWDT-UHFFFAOYSA-N
Molecular formula
C24H39NO3
Average molar mass
389.6 g/mol

Names & identifiers

Preferred name
2-{N,N-di(2-ethylhexyl)carbamoyl}-benzoic acid
IUPAC
2-[bis(2-ethylhexyl)carbamoyl]benzoic acid

Names & synonyms

SCHEMBL10626033GHJHOPDCAVDWDT-UHFFFAOYSA-N2-{N,N-di(2-ethylhexyl)carbamoyl}-benzoic acid

Database identifiers

PubChem CID
20147052

Properties

Computed structural properties

XLogP
7.2
Topological polar surface area
57.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
14
Heavy atoms
28

Related reactions

1 records
New reaction record

Compound notes

Loading…