3-(Trifluoromethyl)thiophenol
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3-(Trifluoromethyl)thiophenol
structure -
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CAS No:
937-00-8
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Formula:
C7H5F3S
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Chemical Name:
3-(Trifluoromethyl)thiophenol
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Synonyms:
3-(Trifluoromethyl)t;3-MERCAPTOBENZOTRIFLUORIDE;M-TRIFLUOROMETHYLTHIOPHENOL;3-(TRIFLUOROMETHYL)THIOPHENOL;3-(TRIFLUOROMETHYL)BENZENETHIOL;m-(Trifluoromethyl)benzenethiol;3-(Trifluoromethyl)thiophenol95%;3-(Trifluoromethyl)thiophenol 95%;3-(TRIFLUOROMETHYL)BENZENE-1-THIOL;3-(Trifluoromethyl)thiophenol3-Mercaptobenzotrifluoride
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CAS No:
Characteristics
38.80000
3.49
clear colorless liquid
1.3±0.1 g/cm3
175.4±40.0 °C at 760 mmHg
63.0±15.6 °C
1.493
Safety Information
3334
R22;R36/37/38
S26-S36/37/39
Xi: Irritant;
P210, P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P370+P378, P403+P233, P403+P235, P405, P501
H227
|Danger|H227 (11.11%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 9 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:178.18
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:178.00640582
Monoisotopic Mass:178.00640582
Topological Polar Surface Area:1
Heavy Atom Count:11
Complexity:132
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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