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Substance Name: 2-Naphthoylmethyl thiocyanate
RN: 19339-62-9
UNII: 32RLP893D3
InChIKey: FGMSBOSKVIWYEW-UHFFFAOYSA-N

Molecular Formula

  • C13-H9-N-O-S

Molecular Weight

  • 227.286
 
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Names and Synonyms

Name of Substance

  • 2-Naphthoylmethyl thiocyanate

Synonyms

  • 2-Naphthoylmethyl thiocyanate
  • 3-08-00-01141 (Beilstein Handbook Reference)
  • BRN 2645976
  • NSC 100758
  • Thiocyanic acid, 2-naphthoylmethyl ester
  • UNII-32RLP893D3

Systematic Names

  • Thiocyanic acid, 2-(2-naphthalenenyl)2-oxoethyl ester (9CI)
  • Thiocyanic acid, 2-(2-naphthalenyl)-2-oxoethyl ester (9CI)
  • Thiocyanic acid, 2-naphthoylmethyl ester

Registry Numbers

CAS Registry Number

  • 19339-62-9

FDA UNII

  • 32RLP893D3

System Generated Number

  • 0019339629

Structure Descriptors

InChI

1S/C13H9NOS/c14-9-16-8-13(15)12-6-5-10-3-1-2-4-11(10)7-12/h1-7H,8H2

InChIKey

FGMSBOSKVIWYEW-UHFFFAOYSA-N

Smiles

C(#N)SCC(c1cc2ccccc2cc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04553,