2-(DIFLUOROMETHYLTHIO)BENZOICACID
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2-(DIFLUOROMETHYLTHIO)BENZOICACID
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CAS No:
79676-56-5
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Formula:
C8H6F2O2S
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Chemical Name:
2-(DIFLUOROMETHYLTHIO)BENZOICACID
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Synonyms:
2-(DIFLUOROMETHYLTHIO)BENZOIC ACID;2-DIFLUOROMETHYLSULFANYL-BENZOIC ACID;2-(Difluoromethylthio)benzoic acid, 97+%;2-(Fluoromethylthio)benzoic acid;2-[(Difluoromethyl)sulphanyl]benzoic acid;2-[(Difluoromethyl)thio]benzoic acid, 2-Carboxyphenyl difluoromethyl sulphide;Benzoic acid, 2-[(difluoromethyl)thio]-
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CAS No:
Safety Information
36/37/38-36-22
26-36
Xi,Xn
|Warning|H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:204.20
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:204.00565693
Monoisotopic Mass:204.00565693
Topological Polar Surface Area:62.6
Heavy Atom Count:13
Complexity:187
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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