2,5-DIMETHOXYTHIOPHENOL
-
2,5-DIMETHOXYTHIOPHENOL
structure -
-
CAS No:
1483-27-8
-
Formula:
C8H10O2S
-
Chemical Name:
2,5-DIMETHOXYTHIOPHENOL
-
Synonyms:
DiMethoxythiophenol;2,5-DIMETHOXYTHIOPHE;2,5-DIMETHOXYTHIOPHENE;2C5-DIMETHOXYTHIOPHENOL;2,5-DIMETHOXYTHIOPHENOL;2,5-DIMETHOXYBENZENETHIOL;2,5-dimethoxybenzene-1-thiol;2,5-Dimethoxybenzenethiol,2,5-Dimethoxyphenylmercaptan
-
CAS No:
Characteristics
19.5
2.30
1.134 g/mL at 25 °C(lit.)
248.3-252.0 °C (decomp)
88-90 °C0.5 mm Hg(lit.)
>230 °F
n 20/D 1.5860(lit.)
Safety Information
III
STENCH 9
2810
3
R20/21/22;R36/38
26-36
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H302 (11.63%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2,5-DIMETHOXYTHIOPHENOL Use and Manufacturing
2,5-Dimethoxythiophenol is a thiophenol derivative used in the preparation of dihydrofolate reductase inhibitors and potential antitumor agents.
Computed Properties
Molecular Weight:170.23
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:170.04015073
Monoisotopic Mass:170.04015073
Topological Polar Surface Area:19.5
Heavy Atom Count:11
Complexity:119
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
