benzyl benzoate

Identification (Source:EPA,EU)

ID 108
Name benzyl benzoate
CAS 120-51-4
IUPAC benzyl benzoate
Inchi InChI=1S/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2
CIPAC
EPA Code 009501
Formula C14H12O2
SMILES c1(C(OCc2ccccc2)=O)ccccc1
Status Not Available

Classification

Mode of Action Attacks the nervous system of mites
Pesticide Type Acaricide, Insecticide, Veterinary treatment, Other product constituent
Chemical Group Bridged diphenyl
Classification bridged diphenyl acaricides

Properties (Source:PubChem)

Molecular Weight 212.25
Physical State Colourless to pale yellow oily liquid with pleasant aromatic odour
AlogP 3.268
H-Bond Donor 0
H-Bond Acceptor 2
Surface Area 207.31
Polar Surface Area 26.3

Structure



ChemMapper Search Option (Docunmentation of ChemMapper)

3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Birds Acute LD50 2000 mg kg-1
Fish Acute 96 hour LC50 4.6 mg l-1
Mammals Acute oral LD50 > 2800 mg kg-1

Related targets

Target Name RScore (About this table)
angiotensin II 247(3,3,3,7) Details
lysozyme 24(0,0,2,14) Details
IgE 8(0,0,1,3) Details
quinone reductase 7(0,0,1,2) Details
cream 1 6(0,0,1,1) Details
Cl 2 6(0,0,1,1) Details
BB2 5(0,0,0,5) Details
BB1 5(0,0,0,5) Details
Docunmentation of Network Visuallization

Network initializing...Please wait

Node List

ID Name Type

Legend:

: Current entry node; : Target node; : Compound node;