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Substance Name: 1H-Tetrazole, 1-phenyl-
RN: 5378-52-9
UNII: 0LCC44M8Y9
InChIKey: IYPXPGSELZFFMI-UHFFFAOYSA-N

Molecular Formula

  • C7-H6-N4

Molecular Weight

  • 146.152
 
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Names and Synonyms

Name of Substance

  • 1H-Tetrazole, 1-phenyl-

Synonym

  • UNII-0LCC44M8Y9

Systematic Name

  • 1H-Tetrazole, 1-phenyl-

Registry Numbers

CAS Registry Number

  • 5378-52-9

FDA UNII

  • 0LCC44M8Y9

System Generated Number

  • 0005378529

Structure Descriptors

InChI

1S/C7H6N4/c1-2-4-7(5-3-1)11-6-8-9-10-11/h1-6H

InChIKey

IYPXPGSELZFFMI-UHFFFAOYSA-N

Smiles

n1(nnnc1)c1ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.09 (none)   EXP
Water Solubility 9250 mg/L 25 EST
Vapor Pressure 2.15E-03 mm Hg 25 EST
Henry's Law Constant 2.22E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.49E-12 cm3/molecule-sec 25 EST

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