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Home > Encyclopedia > 1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione

1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione

1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione structure

1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione 

structure
  • CAS No:

    56610-81-2

  • Formula:

    C3H6N4OS

  • Chemical Name:

    1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione

  • Synonyms:

    5H-Tetrazole-5-thione,1,2-dihydro-1-(2-hydroxyethyl)-;1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione;1-(2-Hydroxyethyl)tetrazole-5-thiol;5-Mercapto-1-tetrazoleethanol;5-Mercapto-1-(2-hydroxyethyl)-1H-tetrazole;1-(2-Hydroxyethyl)-5-mercaptotetrazole;[1-(2-Hydroxyethyl)-1H-1H-tetrazol-5-yl]thiol;1-(2-Hydroxyethyl)-5-mercapto-1H-tetrazole;1-(2-Hydroxyethyl)-1H-tetrazole-5-thiol;1-(2-Hydroxyethyl)-2H-tetrazole-5-thione;2-(5-Sulfanyl-1H-1,2,3,4-tetrazol-1-yl)ethan-1-ol;84314-87-4

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

White crystalline

1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione Basic Attributes

146.17

146.17

1806241-263-5

DTXSID00437877

Characteristics

92.3

0.6

white crystals or crystalline powder

1.8±0.1 g/cm3

137-139ºC

221.4ºC at 760mmHg

2 °C

1.789

Safety Information

UN 1648 3/PG 2

3

11-20/21/22-36-36/37/38-23/24/25

26-36-45-36/37/39-36/37-16

F,Xn,Xi,T

Irritant

1,2-Dihydro-1-(2-hydroxyethyl)-5H-tetrazole-5-thione Use and Manufacturing

2-(5-Mercaptotetrazole-1-yl)ethanolis a mercaptotetrazole derivative used as an intermediate in the preparation of beta-lactam antibiotic Flomoxef (F401850) as well one of its metabolite. 2-(5-Mercaptotetrazole-1-yl)ethanol also shows vitamin K-dependent glutamylcarboxylase inhibitory activity.

Computed Properties

Molecular Weight:146.17
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:146.02623200
Monoisotopic Mass:146.02623200
Topological Polar Surface Area:92.3
Heavy Atom Count:9
Complexity:147
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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