Compound Summary


PARAQUAT
  Compound Information
 PARAQUAT

Compound Name:

PARAQUAT

Compound CID:

15939

Synonyms:

PARAQUAT

4685-14-7

1,1-Dimethyl-4,4-bipyridinium

Paraquat ion

Dimethyl viologen

More...

Iupac Name:

1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium

InChI:

InChI=1S/C12H14N2/c1-13-7-3-11(4-8-13)12-5-9-14(2)10-6-12/h3-10H,1-2H3/q+2

InChIKey:

INFDPOAKFNIJBF-UHFFFAOYSA-N

Canonical Smiles:

C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C

Isomeric Smiles:

C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C

Molecular Weight:

186.25

Molecular Formula:

C12H14N2+2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 PARAQUAT

Molecular Weight:

186.25

Molecular Formula:

C12H14N2+2

Hydrogen Bond Donor Count:

0

Hydrogen Bond Acceptor Count:

0

Rotatable Bond Count:

1

Heavy Atom Count:

14

Complexity:

145

  Synonyms
 PARAQUAT

PARAQUAT PARAQUAT

PARAQUAT

4685-14-7

1,1-Dimethyl-4,4-bipyridinium

Paraquat ion

Dimethyl viologen

Paraquat dication

4,4-Bipyridinium, 1,1-dimethyl-

Starfire

Weedol

Spraytop-graze

Dextrone X

Dextrone

Gramoxone

Methyl viologen ion(2+)

Methyl viologen (2+)

1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium

CCRIS 7731

1,1-Dimethyl-4,4-bipyridyldiylium

HSDB 1668

N,N-Dimethyl-4,4-bipyridinium

Esgram

UNII-PLG39H7695

1,1-Dimethyl-4,4-bipyridinium salt"

1,1-Dimethyl-4,4-bipyridinium cation"

N,N-Dimethyl-4,4-bipyridinium dication"

1,1-dimethyl-4,4-bipyridin-1-ium

CHEBI:34905

1,1-dimethyl-4,4-bipyridium

PLG39H7695

1,1-Dimethyl-4,4-bipyridyldiylium ion (8CI)(9CI)

MLS001332595

Paraquat ANSI:BSI:ISO

1-methyl-4-(1-methyl(4-pyridyl))pyridine

SMR000875209

EINECS 225-141-7

N,N-Dimethyl-gamma,gamma-dipyridylium

Paraquat aqueous solution

ChemDiv3_000231

NCIMech_000502

NCIOpen2_005422

SCHEMBL21652

MLS001304933

BIDD:ER0480

CHEMBL74469

DTXSID3034799

BDBM96275

cid_5351279

HMS1473K11

ZINC3861781

1,1 -dimethyl-4,4-bipyridinium

CCG-35984

SBB090482

STK387391

AKOS001483177

MCULE-6418591101

IDI1_019549

1,1-DIMETHYL-4,4-BIPYRIDYL

NCGC00166161-02

NCI60_002105

S501

SMR000752910

FT-0606133

FT-0652363

ST45025935

1,1-dimethyl-4,4-bipyridin-1,1-diium

685P147

AC-907/25005209

W-106083

Q26841324

1-methyl-4-(1-methyl-4-pyridin-1-iumyl)pyridin-1-ium;chloride

1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium;chloride

KHJ

  Experimental Data
 PARAQUAT

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Drosophila melanogaster 1.000000000000000 mM 58.000000000000000 34.000000000000000 -41.400000000000000 S Dahomey 27076081 Inactive
Caenorhabditis elegans 0.100000000000000 mM 18.370000000000000 22.730000000000000 0.240000000000000 26.000000000000000 34.000000000000000 0.310000000000000 S N2 27683245 Active
Caenorhabditis elegans 200.000000000000000 umol/L 30.900000000000000 34.700000000000000 0.120000000000000 39.300000000000000 42.600000000000000 0.080000000000000 S N2 28992589 Active
Caenorhabditis elegans 5.000000000000000 mM 20.000000000000000 16.000000000000000 -0.200000000000000 S N2 31412639 Inactive
Caenorhabditis elegans 100.000000000000000 umol/L 13.530000000000000 S N2 28054425 Active
Drosophila melanogaster 1.000000000000000 mM 63.000000000000000 35.500000000000000 -43.600000000000000 S Dahomey 27076081 Inactive
Caenorhabditis elegans 0.100000000000000 mM 18.400000000000000 29.000000000000000 0.580000000000000 29.000000000000000 43.000000000000000 0.480000000000000 S N2 21151885 Active
Helicoverpa armigera 0.300000000000000 mM 57.000000000000000 63.000000000000000 0.110000000000000 S MALES 32607183 Active
Helicoverpa armigera 0.400000000000000 mM 57.000000000000000 64.000000000000000 0.120000000000000 S MALES 32607183 Active
Helicoverpa armigera 0.400000000000000 mM 58.000000000000000 64.000000000000000 0.100000000000000 S FEMALES 32607183 Active
Caenorhabditis elegans 0.300000000000000 mM 11.290000000000000 5.000000000000000 -0.560000000000000 19.000000000000000 11.000000000000000 -0.420000000000000 S N2 32910481 Inactive
Drosophila melanogaster 1.000000000000000 mM 56.500000000000000 34.000000000000000 -39.800000000000000 S Dahomey 27076081 Inactive
Helicoverpa armigera 0.300000000000000 mM 58.000000000000000 62.000000000000000 0.070000000000000 NS FEMALES 32607183 Inactive
Drosophila melanogaster 1.000000000000000 mM 54.000000000000000 60.000000000000000 11.100000000000000 S wiso31 29515102 Active
  Experimental Data Visualization
 PARAQUAT

  Statistics Data
 PARAQUAT

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 13.530000000000000 0.480000000000000 6 6
Drosophila melanogaster 11.100000000000000 2 4
Helicoverpa armigera 0.120000000000000 1 4
  Statistics Data Visualization
 PARAQUAT