Compound Summary


5108-96-3
  Compound Information
 5108-96-3

Compound Name:

5108-96-3

Compound CID:

517348

Synonyms:

5108-96-3

Ammonium pyrrolidinedithiocarbamate

Ammonium pyrrolidine-1-carbodithioate

1-Pyrrolidinecarbodithioic acid ammonium salt

apdc

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Iupac Name:

azanium;pyrrolidine-1-carbodithioate

InChI:

InChI=1S/C5H9NS2.H3N/c7-5(8)6-3-1-2-4-6;/h1-4H2,(H,7,8);1H3

InChIKey:

MDDIUTVUBYEEEM-UHFFFAOYSA-N

Canonical Smiles:

C1CCN(C1)C(=S)[S-].[NH4+]

Isomeric Smiles:

C1CCN(C1)C(=S)[S-].[NH4+]

Molecular Weight:

164.3

Molecular Formula:

C5H12N2S2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 5108-96-3

Molecular Weight:

164.3

Molecular Formula:

C5H12N2S2

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

2

Rotatable Bond Count:

0

Heavy Atom Count:

9

Complexity:

91.1

  Synonyms
 5108-96-3

5108-96-3 5108-96-3

5108-96-3

Ammonium pyrrolidinedithiocarbamate

Ammonium pyrrolidine-1-carbodithioate

1-Pyrrolidinecarbodithioic acid ammonium salt

apdc

Pyrrolidinedithiocarbamate ammonium

PDTC

Ammonium 1-pyrrolidinecarbodithioate

Ammonium 1-Pyrrolidinedithiocarbamate

1-Pyrrolidinecarbodithioic acid, ammonium salt

1-Pyrrolidinecarbodithioicacid, ammonium salt (1:1)

Ammonium pyrrolidinecarbodithioate

1-Pyrrolidinedithiocarboxylic acid ammonium salt

Pyrrolidine-N-dithiocarbamic acid ammonium salt

1-Pyrrolidinecarbodithioic acid, ammonuim salt

MLS002153275

C5H9NS2.NH3

SCHEMBL463334

HMS2235G20

HMS3263O07

HMS3266N09

HMS3411D15

HMS3675D15

BCP24770

Tox21_501033

AC2534

Ammonium Pyrrolidine-N-dithiocarbamate

AKOS000121506

CCG-222337

LP01033

NCGC00094322-01

NCGC00261718-01

K976

SMR000326730

SY061866

pyrrolidinylmethanedithioic acid, azamethane

DB-051896

B6422

EU-0101033

P0644

ST50406611

P 8765

A918464

W-105918

  Experimental Data
 5108-96-3

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
Caenorhabditis elegans 33.000000000000000 umol/L -19.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 5108-96-3

  Statistics Data
 5108-96-3

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans -19.000000000000000 1 1
  Statistics Data Visualization
 5108-96-3