1-Methylpyridinium Bis(trifluoromethanesulfonyl)imide

Catalog Number

ACM742086108

CAS

742086-10-8

IUPAC Name

1-methylpyridin-1-ium;1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide

Molecular Weight

374.27

Molecular Formula

C8H8F6N2O4S2

Canonical SMILES

C[N+]1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C6H8N.C2HF6NO4S2/c1-7-5-3-2-4-6-7;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h2-6H,1H3;9H/q+1;

InChI Key

YVRSRPOKULOYIQ-UHFFFAOYSA-N

Melting Point

45 °C

Purity

>98.0%(T)(HPLC)

Solubility

soluble in Methanol

Appearance

White to Almost white powder to crystal

Storage

Store under inert gas

Complexity

420

Covalently-Bonded Unit Count

2

Exact Mass

374.990793g/mol

Hazard Statements

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

Heavy Atom Count

22

MDL Number

MFCD03093293

Monoisotopic Mass

374.990793g/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.

REAXYS Number

10615715

Refractive Index

1.45

• Catalog Number: ACM742086108
• CAS: 742086-10-8
• IUPAC Name: 1-methylpyridin-1-ium;1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide
• Molecular Weight: 374.27
• Molecular Formula: C8H8F6N2O4S2
• Canonical SMILES: C[N+]1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)NS(=O)(=O)C(F)(F)F
• InChI: InChI=1S/C6H8N.C2HF6NO4S2/c1-7-5-3-2-4-6-7;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h2-6H,1H3;9H/q+1
• InChI Key: YVRSRPOKULOYIQ-UHFFFAOYSA-N
• Melting Point: 45 °C
• Purity: >98.0%(T)(HPLC)
• Solubility: soluble in Methanol
• Appearance: White to Almost white powder to crystal
• Storage: Store under inert gas
• Complexity: 420
• Covalently-Bonded Unit Count: 2
• Exact Mass: 374.990793g/mol
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• Heavy Atom Count: 22
• MDL Number: MFCD03093293
• Monoisotopic Mass: 374.990793g/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.
• REAXYS Number: 10615715
• Refractive Index: 1.45