2-Mercapto-4-phenylimidazole
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2-Mercapto-4-phenylimidazole
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CAS No:
6857-34-7
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Formula:
C9H8N2S
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Chemical Name:
2-Mercapto-4-phenylimidazole
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Synonyms:
2H-Imidazole-2-thione,1,3-dihydro-4-phenyl-;Imidazole-2-thiol,4-phenyl-;4-Imidazoline-2-thione,4-phenyl-;Imidazole-2-thiol,4(or 5)-phenyl-;1,3-Dihydro-4-phenyl-2H-imidazole-2-thione;4-Phenyl-2-mercaptoimidazole;2-Mercapto-4-phenylimidazole;2-Mercapto-4(or 5)-phenylimidazole;2-Mercapto-4-phenyl-1H-imidazole;4-Phenyl-2-imidazolethiol;NSC 45834;4-Phenyl-1,3-dihydroimidazole-2-thione;4-Phenyl-1H-imidazole-2-thiol;4-Phenyl-2-imidazolethione;4-Phenyl-1,3-dihydro-2H-imidazole-2-thione;25433-08-3
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CAS No:
2-Mercapto-4-phenylimidazole Basic Attributes
176.24
176.24
KJ6FZP2MLL
45834
DTXSID70218670
2933290090
Safety Information
IRRITANT
NONH for all modes of transport
1
22-41
26-39
Xn
P280-P305 + P351 + P338
H302-H318
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:176.24
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:176.04081944
Monoisotopic Mass:176.04081944
Topological Polar Surface Area:56.2
Heavy Atom Count:12
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes