4-Methoxy-α-toluenethiol
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4-Methoxy-α-toluenethiol
structure -
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CAS No:
6258-60-2
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Formula:
C8H10OS
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Chemical Name:
4-Methoxy-α-toluenethiol
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Synonyms:
Benzenemethanethiol,4-methoxy-;α-Toluenethiol,p-methoxy-;4-Methoxybenzenemethanethiol;(p-Methoxyphenyl)methanethiol;p-Methoxybenzyl mercaptan;p-Methoxybenzenemethanethiol;4-Methoxybenzyl mercaptan;4-Methoxy-α-toluenethiol;(4-Methoxyphenyl)methanethiol;(4-Methoxyphenyl)methylthiol;4-Methoxybenzylthiol;p-Methoxy-α-toluenethiol;p-Methoxybenzylthiol;[4-(Methyloxy)phenyl]methanethiol;4-Methoxytoluenethiol;4-Methoxy-alpha-toluenethiol
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CAS No:
Characteristics
10.2
2.65
Clear colorless to light yellow Liquid
1.1±0.1 g/cm3
89-94 °C @ Press: 2.5 Torr
>230 °F
1.549
Not miscible or difficult to mix in water.
2-8°C
Safety Information
UN 3334
3
23-24/25
P261, P264, P270, P271, P272, P280, P285, P301+P312, P302+P352, P304+P340, P304+P341, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, P501
H302
|Danger|H302 (83.33%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P285, P301+P312, P302+P352, P304+P340, P304+P341, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:154.23
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:154.04523611
Monoisotopic Mass:154.04523611
Topological Polar Surface Area:10.2
Heavy Atom Count:10
Complexity:87.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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