Introduction: Basic information about CAS 7217-59-6|2-Methoxybenzenethiol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name 2-Methoxybenzenethiol CAS Number 7217-59-6 Molecular Weight 140.203 Density 1.1±0.1 g/cm3 Boiling Point 235.4±0.0 °C at 760 mmHg Molecular Formula C7 H8 OS Melting Point / MSDS USA Flash Point 95.6±0.0 °C Symbol GHS07Signal Word Warning
Names Name 2-methoxybenzenethiol Synonym More Synonyms
Chemical & Physical Properties Density 1.1±0.1 g/cm3 Boiling Point 235.4±0.0 °C at 760 mmHg Molecular Formula C7 H8 OS Molecular Weight 140.203 Flash Point 95.6±0.0 °C Exact Mass 140.029587 PSA 48.03000 LogP 2.23 Vapour Pressure 0.1±0.4 mmHg at 25°C Index of Refraction 1.566 InChIKey DSCJETUEDFKYGN-UHFFFAOYSA-N SMILES COc1ccccc1S
Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : DC1790000 CHEMICAL NAME : Benzenethiol, o-methoxy- CAS REGISTRY NUMBER : 7217-59-6 BEILSTEIN REFERENCE NO. : 2042178 LAST UPDATED : 199701 DATA ITEMS CITED : 3 MOLECULAR FORMULA : C7-H8-O-S MOLECULAR WEIGHT : 140.21 WISWESSER LINE NOTATION : SHR BO1 HEALTH HAZARD DATAACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 1740 mg/kg TOXIC EFFECTS : Behavioral - changes in motor activity (specific assay) Behavioral - ataxia Lungs, Thorax, or Respiration - respiratory depression REFERENCE : FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 19,753,1981 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1560 mg/kg TOXIC EFFECTS : Behavioral - changes in motor activity (specific assay) Behavioral - ataxia Lungs, Thorax, or Respiration - respiratory depression REFERENCE : FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 19,753,1981
Safety Information Symbol GHS07Signal Word Warning Hazard Statements H302-H315-H319-H335 Precautionary Statements P261-P305 + P351 + P338 Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter Hazard Codes Xn:Harmful; Risk Phrases R22;R36/37/38 Safety Phrases S26-S36/37 RIDADR 3334 WGK Germany 3 RTECS DC1790000 HS Code 2930909090
Customs HS Code 2930909090 Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
Articles5 More Articles
Identifying chelators for metalloprotein inhibitors using a fragment-based approach.J. Med. Chem. 54 , 591-602, (2011)
Fragment-based lead design (FBLD) has been used to identify new metal-binding groups for metalloenzyme inhibitors. When screened at 1 mM, a chelator fragment library (CFL-1.1) of 96 compounds produced...
Detail Acute toxicity of thioguaiacol and of versalide in rodents.Food Cosmet. Toxicol. 19(6) , 753-5, (1981)
Detail Asymmetric conjugate addition of thiols to chiral methacryloyloxazolidinones. Tseng T-C and Wu M-J.Tetrahedron Asymmetry 6(7) , 1633-40, (1995)
Synonyms Thioguaiacol 2-OMe-C6H4-SH EINECS 230-605-7 O-METHOXYTHIOPHENOL o-methoxy-benzenethio 2-METHOXYTHIOPHENOL Benzenethiol, 2-methoxy- o-methoxybenzenethiol 2-Methoxybenzenethiol 2-methoxy-benzenethio 2-Methoxythiophenole MFCD00004834 methoxybenzenethiol 2-MERCAPTOANISOLE