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Home > Encyclopedia > methyl imidazole-1-carbodithioate

methyl imidazole-1-carbodithioate

methyl imidazole-1-carbodithioate structure

methyl imidazole-1-carbodithioate 

structure
  • CAS No:

    74734-11-5

  • Formula:

    C5H6N2S2

  • Chemical Name:

    methyl imidazole-1-carbodithioate

  • Synonyms:

    imidazole-1-carbodithioic acid methyl ester; methyl 1H-imidazole-1-carbodithioate; methyl 1-imidazolecarbodithioate; 1-(methyldithiocarbonyl)imidazole; 1H-Imidazole-1-carbodithioic acid methyl ester;

  • Categories:

    Organic Chemistry  >  Alcohols, Phenols, Phenol Alcohols

methyl imidazole-1-carbodithioate Basic Attributes

158.24500

157.99724055

DTXSID40453753

2933290090

Characteristics

75.21000

1.37910

1.294g/cm3

29-33ºC

285.36ºC

110ºC

n20/D 1.6741

Safety Information

R22; R37/38; R41; R43

S26; S36/37/39

Xn

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P333+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:158.2
XLogP3:1.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:157.99724055
Monoisotopic Mass:157.99724055
Topological Polar Surface Area:75.2
Heavy Atom Count:9
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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