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Heptafluoroisobutylene methyl ether

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Name

Heptafluoroisobutylene methyl ether

EINECS N/A
CAS No. 360-53-2 Density 1.424g/cm3
PSA 9.23000 LogP 2.93850
Solubility N/A Melting Point N/A
Formula C5H3 F7 O Boiling Point 91.7°Cat760mmHg
Molecular Weight 212.067 Flash Point 14.6°C
Transport Information N/A Appearance N/A
Safety Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of F. See also ETHERS. Risk Codes 23/24/25
Molecular Structure Molecular Structure of 360-53-2 (1-METHOXY-(PERFLUORO-2-METHYL-1-PROPENE)) Hazard Symbols
Synonyms

Ether,methyl 1,3,3,3-tetrafluoro-2-(trifluoromethyl)propenyl (6CI,7CI); Ether, methyltetrafluoro-2-(trifluoromethyl)propenyl (8CI);1,3,3,3-Tetrafluoro-1-methoxy-2-(trifluoromethyl)-1-propene;Heptafluoroisobutenyl methyl ether; Methyl perfluoroisobutenyl ether

Article Data 11

Heptafluoroisobutylene methyl ether Chemical Properties

Molecular Structure of Heptafluoroisobutylene methyl ether (CAS NO. 360-53-2):

IUPAC Name: 1,3,3,3-Tetrafluoro-1-methoxy-2-(trifluoromethyl)prop-1-ene 
Molecular Formula: C5H3F7O
Molecular Weight: 212.065542 g/mol
XLogP3-AA: 3
H-Bond Donor: 0
H-Bond Acceptor: 8
Canonical SMILES: COC(=C(C(F)(F)F)C(F)(F)F)F
InChI: InChI=1S/C5H3F7O/c1-13-3(6)2(4(7,8)9)5(10,11)12/h1H3
InChIKey: FSDLLONBRLBIBL-UHFFFAOYSA-N
Index of Refraction: 1.299
Molar Refractivity: 27.77 cm3
Molar Volume: 148.8 cm3
Surface Tension: 13.8 dyne/cm
Density: 1.424 g/cm3
Flash Point: 14.6 °C
Enthalpy of Vaporization: 31.79 kJ/mol
Boiling Point: 91.7 °C at 760 mmHg
Vapour Pressure: 60.3 mmHg at 25 °C
Water Solubility: 438.8 mg/L at 25 °C
Refractive Index: 1.317 
BRN: 1787514

Heptafluoroisobutylene methyl ether Toxicity Data With Reference

1.    

orl-mus LD50:1070 mg/kg

    TXAPA9    Toxicology and Applied Pharmacology. 14 (1969),114.
2.    

orl-rat LD50:1070 mg/kg

    TXAPA9    Toxicology and Applied Pharmacology. 14 (1969),114.
3.    

ipr-mus LD50:66 mg/kg

    TXAPA9    Toxicology and Applied Pharmacology. 12 (1968),486.
4.    

ivn-mus LD50:58 mg/kg

    TXAPA9    Toxicology and Applied Pharmacology. 12 (1968),486.

Heptafluoroisobutylene methyl ether Safety Profile

Safety Information of Heptafluoroisobutylene methyl ether (CAS NO. 360-53-2):
Hazard Codes: T Toxic
Hazard Note: Toxic
Risk Statements: 23/24/25
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed
Safety Statements: 26-36-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S36:Wear suitable protective clothing
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: 2810
Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of F. See also ETHERS.

Heptafluoroisobutylene methyl ether Specification

  Heptafluoroisobutylene methyl ether with cas registry number of 360-53-2 is also known as 4-01-00-03454 (Beilstein Handbook Reference) ; Ether, methyl 1,3,3,3-tetrafluoro-2-(trifluoromethyl)propenyl ; Methyl perfluoroisobutenyl ether ; 1-Propene, 1,3,3,3-tetrafluoro-1-methoxy-2-(trifluoromethyl)- ; 1-Propene, 1,3,3,3-tetrafluoro-1-methoxy-2-(trifluoromethyl)- (9CI) ; Ether, methyl heptafluoroisobutenyl ; Ether, methyl tetrafluoro-2-(trifluoromethyl)propenyl (8CI) .

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