CAS 25236-64-0 2,2,2-Trifluoroethyl Methanesulfonate (HCID 556565)

Names & identifiers

Preferred name: 2,2,2-Trifluoroethyl Methanesulfonate
IUPAC: 2,2,2-trifluoroethyl methanesulfonate
English name: 2,2,2-Trifluoroethyl methanesulfonate
Molecular formula: C3H5F3O3S
Molecular weight: 178.13

Names & synonyms

2,2,2-Trifluoroethyl methanesulfonate25236-64-0Ethanol, 2,2,2-trifluoro-, 1-methanesulfonateICECLJDLAVVEOW-UHFFFAOYSA-DTXSID20339501RefChem:80808DTXCID20290582607-659-9ICECLJDLAVVEOW-UHFFFAOYSA-NInChI=1/C3H5F3O3S/c1-10(7,8)9-2-3(4,5)6/h2H2,1H32,2,2-trifluoromethyl mesylateMFCD00025058

Show more names

Tresylklorid2,2,2-Trifluoro-ethanol 1-mesylate5,5,5-trifluoro-2-methylenepentanoate2,2,2-TrifluoroethylMethanesulfonate>2,2,2-Trifluoroethylmethanesulphonate98%2,2,2-Trifluoroethyl methanesulphonate 98%

Methanesulfonic Acid 2,2,2-Trifluoroethyl Ester2,2,2-trifluoroethyl methanesulphonate2,2,2-trifluoroethyl mesylate2,2,2-trifluoroethyl methylsulfonate2,2,2-Trifluoro-ethanol 1-methanesulfonateCF3CH2OSO2CH3SCHEMBL796831SBB089376

Database identifiers

CAS: 25236-64-0
PubChem CID: 556565
DTXSID: DTXSID20339501
EC Number: 607-659-9
Nikkaji: J1.222.500H

Properties

Computed structural properties

XLogP: 0.8
Topological polar surface area: 51.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 186

Physicochemical properties

Boiling point: 99 °C · 99 °C / 35mmHg
Density: 1.513 g/mL · 1.513 g/mL at 20 °C (lit.)
refractive index: 20 · n20/D 1.367
Flash point: 103 °C · 103°C
storage temp.: 2 · Storage temp. 2-8°C
form: clear liquid
Specific Gravity: 1.52 · 1.520
color: Colorless to Light yellow
BRN: 1863049 · 1863049
InChI: InChI=1S/C3H5F3O3S/c1-10(7,8)9-2-3(4,5)6/h2H2,1H3
InChIKey: ICECLJDLAVVEOW-UHFFFAOYSA-N
SMILES: C(OS(C)(=O)=O)C(F)(F)F
CAS DataBase Reference: 25236 · 25236-64-0(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P305+P351+P338-P310
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes: C
Risk Statements: 34 · 34-35
Safety Statements: 26 · 26-36/37/39-45
RIDADR: 3265 · UN 3265 8/PG 3
WGK Germany: 3 · 3
F: 10 · 10-21
Hazard Note: Corrosive
HazardClass: 8 · 8
PackingGroup: III
HS Code: 29055900 · 29055900
Storage Class: 8 A · 8A - Combustible corrosive hazardous materials
Hazard Classifications: 1 B · Skin Corr. 1B

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302+H332 (39.4%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation]

P260, P261, P264, P270, P271, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 71 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.