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Home > Encyclopedia > 1-TERT-BUTYL-1,4-DIHYDRO-TETRAZOLE-5-THIONE

1-TERT-BUTYL-1,4-DIHYDRO-TETRAZOLE-5-THIONE

1-TERT-BUTYL-1,4-DIHYDRO-TETRAZOLE-5-THIONE structure

1-TERT-BUTYL-1,4-DIHYDRO-TETRAZOLE-5-THIONE 

structure
  • CAS No:

    7624-35-3

  • Formula:

    C5H10N4S

  • Chemical Name:

    1-TERT-BUTYL-1,4-DIHYDRO-TETRAZOLE-5-THIONE

  • Synonyms:

    1-tert-butyl-1H-tetrazole-5-thiol;1-tert-butyl-1H-1,2,3,4-tetrazole-5-thiol;5H-Tetrazole-5-thione, 1-(1,1-dimethylethyl)-1,2-dihydro-;1-tert-butyl-1H-tetrazol-5-yl thiol;1-tert-butyl-2H-tetrazole-5-thione;Maybridge1_007053;1-t-butyltetrazole-5-thiol;SCHEMBL2910271;SCHEMBL9192473;CTK2G8005

1-TERT-BUTYL-1,4-DIHYDRO-TETRAZOLE-5-THIONE Basic Attributes

158.22500

158.06300

DTXSID40369603

2933990090

Characteristics

78.59000

1.09070

1.31g/cm3

98-99 °C

168.6ºC at 760 mmHg

55.8ºC

1.639

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:158.23
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:158.06261751
Monoisotopic Mass:158.06261751
Topological Polar Surface Area:72.1
Heavy Atom Count:10
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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