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Substance Name: 2-Naphthalenethiol
RN: 91-60-1
UNII: SZ5U1S741V
InChIKey: RFCQDOVPMUSZMN-UHFFFAOYSA-N

Molecular Formula

  • C10-H8-S

Molecular Weight

  • 160.239
 
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Names and Synonyms

Name of Substance

  • 2-Naphthalenethiol

Synonyms

  • 2-Mercaptonaphthalene
  • 2-Naphthyl mercaptan
  • 2-Naphthyl thiol
  • 2-Thionaphthol
  • 4-06-00-04312 (Beilstein Handbook Reference)
  • AI3-52481
  • beta-Mercaptonaphthalene
  • beta-Naphthalenethiol
  • beta-Naphthyl mercaptan
  • BRN 0636389
  • EINECS 202-082-5
  • FEMA No. 3314
  • Naphthalene-2-thiol
  • NSC 4749
  • Renacit 1
  • RPA 2
  • RPA No. 2
  • Thionaphthol
  • UNII-SZ5U1S741V
  • USAF CY-4
  • Vulcamel TBN

Systematic Name

  • 2-Naphthalenethiol

Superlist Name

  • 2-Naphthalenethiol

Registry Numbers

CAS Registry Number

  • 91-60-1

FDA UNII

  • SZ5U1S741V

System Generated Number

  • 0000091601

Structure Descriptors

InChI

1S/C10H8S/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

InChIKey

RFCQDOVPMUSZMN-UHFFFAOYSA-N

Smiles

c12c(ccc(c1)S)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   National Technical Information Service. Vol. AD277-689,
mouse LD50 oral 385mg/kg (385mg/kg)   Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 81 deg C   EXP
Boiling Point 288 deg C   EXP
log P (octanol-water) 3.860 (none)   EST
Atmospheric OH Rate Constant 1.25E-10 cm3/molecule-sec 25 EST

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