Basic information
- Standard SMILES
FC(F)(F)CI- InChIKey
RKOUFQLNMRAACI-UHFFFAOYSA-N- Molecular formula
- C2H2F3I
- Average molar mass
- 209.94 g/mol
- Monoisotopic mass
- 209.91533272
Overview
structure in first source
Names & identifiers
- Preferred name
- 1,1,1-Trifluoro-2-iodoethane
- IUPAC
- 1,1,1-trifluoro-2-iodoethane
- English name
- 2-Iodo-1,1,1-trifluoroethane
- Molecular formula
- C2H2F3I
- Molecular weight
- 209.94
Names & synonyms
1,1,1-Trifluoro-2-iodoethane353-83-32-Iodo-1,1,1-trifluoroethane2,2,2-Trifluoroethyl iodide1,1,1-TrifluoroiodoethaneEthane, 1,1,1-trifluoro-2-iodo-CA0J38WE9ZDTXSID80188810RefChem:70856DTXCID40111301206-541-0Trifluoroethyl iodide
Show more names
TRIFLUORO IODOETHANEuoro-2-iodoethane1H,1H-Perfluoroethyl iodide
1-Iodo-2,2,2-trifluoroethane1,1,1-trifluoro-2-iodo-ethaneMFCD000010822,2,2-trifluoroiodoethaneCF3CH2IC2H2F3I2,2,2-trifluoro-1-iodoethaneEthane,1,1,1-trifluoro-2-iodo-
Database identifiers
- CAS
353-83-3- PubChem CID
- 67709
- DTXSID
DTXSID80188810- UNII
- CA0J38WE9Z
- EC Number
- 206-541-0
- Nikkaji
- J149.904A
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 38.5
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 54.8 °C · 54.8 °C(lit.)
- Density
- 2.13 g/mL · 2.13 g/mL at 25 °C(lit.)
- vapor pressure
- 3.96 psi · 3.96 psi ( 20 °C)
- refractive index
- 20 · n20/D 1.401(lit.)
- Flash point
- 53 · 53-55°C
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform
- form
- Liquid
- Specific Gravity
- 2.149 · 2.149
- color
- Clear colorless to pink
- Water Solubility
- Insoluble
- Sensitive
- Light Sensitive
- BRN
- 1733201 · 1733201
- InChI
- 1S/C2H2F3I/c3-2(4,5)1-6/h1H2
- InChIKey
- RKOUFQLNMRAACI-UHFFFAOYSA-N
- SMILES
- FC(F)(F)CI
- CAS DataBase Reference
- 353 · 353-83-3(CAS DataBase Reference)
- FDA UNII
- 0 J38WE9Z · CA0J38WE9Z
- NIST Chemistry Reference
- 1 · 1,1,1-Trifluoro-2-iodoethane(353-83-3)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36-37/39
- WGK Germany
- 3 · 3
- F
- 8 · 8
- Hazard Note
- Irritant/Keep Cold/Light Sensitive
- HazardClass
- IRRITANT
- HS Code
- 29037990 · 29037990
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information2-Iodo-1,1,1-trifluoroethane: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 8
- PPE
- Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29037990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant/Keep Cold/Light Sensitive
- safety_code
- 26-36-37/39
- hazard_class
- IRRITANT
- Storage Class
- 10 - Combustible liquids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses1,1,1-Trifluoro-2-iodoethane (cas# 353-83-3) is a compound useful in organic synthesis.
Uses1,1,1-Trifluoro-2-iodoethane (cas# 353-83-3) is a compound useful in organic synthesis.
Upstream & downstream products
Downstream products
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Related reactions
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