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Substance Name: Nicotine sulfate [ISO]
RN: 65-30-5
UNII: UX4GTH155W
InChIKey: IECQULMJVNSKDB-RCWTXCDDSA-N

Molecular Formula

  • C10-H14-N2.1/2H2-O4-S

Molecular Weight

  • 422.547
 

Classification Codes

Classification Codes

  • Agricultural Chemical
  • Insecticide
  • Reproductive Effect

Superlist Classification Code

  • Threshold Planning Quantity (TPQ) = 100/10000 lb
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Names and Synonyms

Results Name

  • Nicotine sulfate [ISO]

Name of Substance

  • Nicotine sulfate
  • Nicotine sulfate [ISO]

Synonyms

  • (S)-3-(1-Methyl-2-pyrrolidinyl)pyridine sulfate (2:1)
  • AI3-02435
  • Black leaf 40
  • Black leaf 40 garden spray
  • Caswell No. 597A
  • EINECS 200-606-7
  • ENT 2,435
  • EPA Pesticide Chemical Code 056703
  • HSDB 805
  • l-1-Methyl-2-(3-pyridyl)-pyrrolidine sulfate
  • l-3-(1-Methyl-2-pyrrolidyl)pyridine sulfate
  • Nicotine sulfate
  • Nicotine, sulfate (2:1)
  • Nikotinsulfat
  • Nikotinsulfat [German]
  • Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (S)-, sulfate (2:1)
  • Pyrrolidine, 1-methyl-2-(3-pyridyl)-, sulfate
  • Sulfate de nicotine
  • Sulfate de nicotine [French]
  • UNII-UX4GTH155W

Systematic Names

  • Nicotine sulphate
  • Nicotine, sulfate (2:1)
  • Pyridine, 3-((2S)-1-methyl-2-pyrrolidinyl)-, sulfate (2:1)
  • Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (S)-, sulfate (2:1)

Superlist Names

  • Nicotine sulfate
  • Nicotine sulfate, solid or solution
  • Nicotine sulfate, solid or solution [UN1658] [Poison]
  • UN1658

Registry Numbers

CAS Registry Number

  • 65-30-5

FDA UNII

  • UX4GTH155W

System Generated Number

  • 0000065305

Molecular Formulas

Molecular Formula

  • C10-H14-N2.1/2H2-O4-S

Molecular Formula Fragments

  • C10-H14-N2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C10H14N2.H2O4S/c2*1-12-7-3-5-10(12)9-4-2-6-11-8-9;1-5(2,3)4/h2*2,4,6,8,10H,3,5,7H2,1H3;(H2,1,2,3,4)/t2*10-;/m00./s1

InChIKey

IECQULMJVNSKDB-RCWTXCDDSA-N

Smiles

CN1CCC[C@H]1c2cccnc2.CN3CCC[C@H]3c4cccnc4.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 32mg/kg (32mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
cat LD50 intraperitoneal 20mg/kg (20mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 86, 1982.
duck LD50 oral 75mg/kg (75mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
mouse LD50 intraperitoneal 10200ug/kg (10.2mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 38, Pg. 54, 1986.
mouse LD50 oral 8550ug/kg (8.55mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: TREMOR
Hygiene and Sanitation Vol. 34(4-6), Pg. 187, 1969.
pigeon LD50 oral 75mg/kg (75mg/kg)   Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
quail LD50 oral 316mg/kg (316mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
rabbit LD50 skin 50mg/kg (50mg/kg)   "Pflanzenschutz-und Schaedlingsbekaempfungsmittel: Abriss einer Toxikologie und Therapie von Vergiftungen," 2nd ed., Klimmer, O.R., Hattingen, Fed. Rep. Ger., Hundt-Verlag, 1971Vol. -, Pg. 141, 1971.
rat LC50 inhalation 22mg/m3 (22mg/m3)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 86, 1982.
rat LD50 oral 50mg/kg (50mg/kg)   Agricultural Research Service, USDA Information Memorandum. Vol. 20, Pg. 16, 1966.
rat LD50 skin 285mg/kg (285mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Toxicology and Applied Pharmacology. Vol. 2, Pg. 88, 1960.
rat LD90 intraperitoneal 29mg/kg (29mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Nutrition Reports International. Vol. 23, Pg. 43, 1981.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.400 (none)   EST
Water Solubility 2.06E+05 mg/L 25 EST
Vapor Pressure 1.96E-11 mm Hg 25 EST
Atmospheric OH Rate Constant 2.02E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.