1-Hexyl-3-methylimidazolium bis(trifluormethylsulfonyl)imide

Catalog Number

ACM382150507-1

CAS

382150-50-7

Structure

Description

1-Hexyl-3-methylimidazolium bis(trifluormethylsulfonyl)imide is a 1-alkyl-3-methylimidazolium based ionic liquid. The solubility of gases such as oxygen and methane in HMIM TFS can be improved in the presence of carbon dioxide.

Synonyms

HMIMBTI,HMIMTFS

IUPAC Name

bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methylimidazol-3-ium

Molecular Weight

447.41

Molecular Formula

C12H19F6N3O4S2

Canonical SMILES

CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

InChI

1S/C10H19N2.C2F6NO4S2/c1-3-4-5-6-7-12-9-8-11(2)10-12;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h8-10H,3-7H2,1-2H3;/q+1;-1

InChI Key

RCNFOZUBFOFJKZ-UHFFFAOYSA-N

Boiling Point

>350 °C (lit.)

Melting Point

25-35 °C

Flash Point

Not applicable

Purity

98%

Appearance

Colorless to Light orange to Yellow clear liquid

Storage

Store under inert gas, 2-8°C

Complexity

488

Covalently-Bonded Unit Count

2

Empirical Formula

C12H19F6N3O4S2

Exact Mass

447.072117g/mol

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

27

MDL Number

MFCD08458931

Monoisotopic Mass

447.072117g/mol

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Refractive Index

n20/D 1.435 (lit.)

• Catalog Number: ACM382150507-1
• CAS: 382150-50-7
• Description: 1-Hexyl-3-methylimidazolium bis(trifluormethylsulfonyl)imide is a 1-alkyl-3-methylimidazolium based ionic liquid. The solubility of gases such as oxygen and methane in HMIM TFS can be improved in the presence of carbon dioxide.
• Synonyms: HMIMBTI,HMIMTFS
• IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-hexyl-3-methylimidazol-3-ium
• Molecular Weight: 447.41
• Molecular Formula: C12H19F6N3O4S2
• Canonical SMILES: CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
• InChI: 1S/C10H19N2.C2F6NO4S2/c1-3-4-5-6-7-12-9-8-11(2)10-12;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h8-10H,3-7H2,1-2H3;/q+1;-1
• InChI Key: RCNFOZUBFOFJKZ-UHFFFAOYSA-N
• Boiling Point: >350 °C (lit.)
• Melting Point: 25-35 °C
• Flash Point: Not applicable
• Purity: 98%
• Appearance: Colorless to Light orange to Yellow clear liquid
• Storage: Store under inert gas, 2-8°C
• Complexity: 488
• Covalently-Bonded Unit Count: 2
• Empirical Formula: C12H19F6N3O4S2
• Exact Mass: 447.072117g/mol
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• Heavy Atom Count: 27
• MDL Number: MFCD08458931
• Monoisotopic Mass: 447.072117g/mol
• Precautionary Statements: P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
• Refractive Index: n20/D 1.435 (lit.)