1-Butyl-3-methylimidazolium Methyl Sulfate

Catalog Number

ACM401788985-1

CAS

401788-98-5

Structure

Synonyms

BMIMMeSO4

IUPAC Name

1-butyl-3-methylimidazol-3-ium;methyl sulfate

Molecular Weight

250.31

Molecular Formula

C9H18N2O4S

Canonical SMILES

CCCCN1C=C[N+](=C1)C.COS(=O)(=O)[O-]

InChI

1S/C8H15N2.CH4O4S/c1-3-4-5-10-7-6-9(2)8-10;1-5-6(2,3)4/h6-8H,3-5H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1

InChI Key

MEMNKNZDROKJHP-UHFFFAOYSA-M

Melting Point

75-80 °C (lit.)

Flash Point

Not applicable

Purity

>98.0%(HPLC)

Density

1.22 g/cm³ (21 °C)

Appearance

Light yellow to Yellow to Orange clear liquid

Storage

Store under inert gas, -20℃

Complexity

184

Conductivity

2.20 mS/cm (30 °C)

Covalently-Bonded Unit Count

2

EC Number

609-790-7

ECW

4.3 V

Empirical Formula

C9H18N2O4S

Exact Mass

250.098728g/mol

Hazard Statements

H314 : Causes severe skin burns and eye damage.H290 : May be corrosive to metals.

Heavy Atom Count

16

MDL Number

MFCD03095437

Monoisotopic Mass

250.098728g/mol

Precautionary Statements

P501 : Dispose of contents/ container to an approved waste disposal plant.P234 : Keep only in original container.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P390 : Absorb spillage to prevent material damage.P303 + P361 + P353 : IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.P301 + P330 + P331 : IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.P363 : Wash contaminated clothing before reuse.P304 + P340 + P310 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Immediately call a POISON CENTER/doctor.P305 + P351 + P338 + P310 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Immediately call a POISON CENTER/doctor.P406 : Store in corrosive resistant container with a resistant inner liner.P405 : Store locked up.

REAXYS Number

9520931

Refractive Index

n20/D 1.478

Viscosity

163 cP (25 °C)

• Catalog Number: ACM401788985-1
• CAS: 401788-98-5
• Synonyms: BMIMMeSO4
• IUPAC Name: 1-butyl-3-methylimidazol-3-ium;methyl sulfate
• Molecular Weight: 250.31
• Molecular Formula: C9H18N2O4S
• Canonical SMILES: CCCCN1C=C[N+](=C1)C.COS(=O)(=O)[O-]
• InChI: 1S/C8H15N2.CH4O4S/c1-3-4-5-10-7-6-9(2)8-10;1-5-6(2,3)4/h6-8H,3-5H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
• InChI Key: MEMNKNZDROKJHP-UHFFFAOYSA-M
• Melting Point: 75-80 °C (lit.)
• Flash Point: Not applicable
• Purity: >98.0%(HPLC)
• Density: 1.22 g/cm³ (21 °C)
• Appearance: Light yellow to Yellow to Orange clear liquid
• Storage: Store under inert gas, -20℃
• Complexity: 184
• Conductivity: 2.20 mS/cm (30 °C)
• Covalently-Bonded Unit Count: 2
• EC Number: 609-790-7
• ECW: 4.3 V
• Empirical Formula: C9H18N2O4S
• Exact Mass: 250.098728g/mol
• Hazard Statements: H314 : Causes severe skin burns and eye damage.H290 : May be corrosive to metals.
• Heavy Atom Count: 16
• MDL Number: MFCD03095437
• Monoisotopic Mass: 250.098728g/mol
• Precautionary Statements: P501 : Dispose of contents/ container to an approved waste disposal plant.P234 : Keep only in original container.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P390 : Absorb spillage to prevent material damage.P303 + P361 + P353 : IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.P301 + P330 + P331 : IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.P363 : Wash contaminated clothing before reuse.P304 + P340 + P310 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Immediately call a POISON CENTER/doctor.P305 + P351 + P338 + P310 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Immediately call a POISON CENTER/doctor.P406 : Store in corrosive resistant container with a resistant inner liner.P405 : Store locked up.
• REAXYS Number: 9520931
• Refractive Index: n20/D 1.478
• Viscosity: 163 cP (25 °C)