chlordane

Identification (Source:EPA,EU)

ID 1474
Name chlordane
CAS 57-74-9
IUPAC 1,2,4,5,6,7,8,8-octachloro-2,3,3a,4,7,7a-hexahydro-4,7-methanoindene
Inchi InChI=1S/C10H6Cl8/c11-3-1-2-4(5(3)12)9(16)7(14)6(13)8(2,15)10(9,17)18/h2-5H,1H2
CIPAC 13
EPA Code 058201
Formula C10H6Cl8
SMILES Cl/C2=C(\Cl)C3(Cl)C1CC(Cl)C(Cl)C1C2(Cl)C3(Cl)Cl
Status Not Approved

Classification

Mode of Action Non systemic with contact, stomach and respiratory action. GABA-gated chloride channel antagonist.
Pesticide Type Insecticide
Chemical Group Cyclodiene organochlorine
Classification cyclodiene insecticides

Properties (Source:PubChem)

Molecular Weight 409.78
Physical State Straw coloured viscous liquid in raw state but powder in product form
AlogP 4.788
H-Bond Donor 0
H-Bond Acceptor 0
Surface Area 302.79
Polar Surface Area 0.0

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
Aquatic invertebrates Acute 48 hour EC50 0.59 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.07 mg l-1
Birds Acute LD50 83 mg kg-1
Fish Acute 96 hour LC50 0.09 mg l-1
Honeybees Acute 48 hour LD50 6.0 μg bee-1
Mammals Acute oral LD50 460 mg kg-1
Mammals Short term dietary NOEL 5 mg kg-1
Sediment dwelling organisms Acute 96 hour LC50 0.01 mg l-1
Bio-concentration factor CT50 Not available days
Bio-concentration factor BCF 20000

Related targets

Target Name RScore (About this table)
estrogen receptor 213(2,3,3,23) Details
estrogen related receptor alpha 180(2,2,2,20) Details
U82 192(1,4,7,7) Details
SRBC 114(1,2,2,4) Details
ras oncogene (protein family or complex) 112(1,2,2,2) Details
ATPase 98(1,1,3,8) Details
MC 2 94(1,1,3,4) Details
Hsp89 85(1,1,1,5) Details
ERbeta 83(1,1,1,3) Details
epoxide hydratase 82(1,1,1,2) Details
Acetylcholinesterase 82(1,1,1,2) Details
RARbeta 81(1,1,1,1) Details
ribonuclease 81(1,1,1,1) Details
CYP17A1 81(1,1,1,1) Details
MC7 167(0,5,7,7) Details
calcium channel (protein family or complex) 62(0,2,2,2) Details
ATPases 50(0,1,4,5) Details
Connexin 43 40(0,1,1,10) Details
muscles 39(0,1,1,9) Details
CYP1A1 38(0,1,1,8) Details
U83 37(0,1,2,2) Details
epidermal growth factor 37(0,1,2,2) Details
CYP2B 34(0,1,1,4) Details
HSD17B4 33(0,1,1,3) Details
IFNG 32(0,1,1,2) Details
immunoglobulin (protein family or complex) 32(0,1,1,2) Details
transferrin 32(0,1,1,2) Details
CYP3A 31(0,1,1,1) Details
HSD17B1 31(0,1,1,1) Details
CC1 31(0,1,1,1) Details
cytochrome P450 (protein family or complex) 36(0,0,2,26) Details
alkaline phosphatase 21(0,0,3,6) Details
pg m 20(0,0,2,10) Details
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