What is the molecular formula of 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate?

The molecular formula is C10H17F3N2O3S.

What is the computed molecular weight of 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate?

The computed molecular weight is 302.32 g/mol.

What are some synonyms for 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate?

Some synonyms include 1-BUTYL-2,3-DIMETHYLIMIDAZOLIUM TRIFLUOROMETHANESULFONATE and 1-butyl-2,3-dimethylimidazolium triflate.

What is the InChIKey of 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate?

The InChIKey is KSOGGGZFEJTGPZ-UHFFFAOYSA-M.

How many hydrogen bond acceptors does 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate have?

It has 6 hydrogen bond acceptors.

What is the exact mass of 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate?

The exact mass is 302.09119807 g/mol.

Which parent compound does 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate relate to?

It relates to Trifluoromethanesulfonic acid.

What is the topological polar surface area of 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate?

The topological polar surface area is 74.4 Å².

Is 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate a canonicalized compound?

Yes, it is a canonicalized compound.

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1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate

Name: 1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate
SKU: ACM765910734
Rating: 5 (1 reviews)

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Catalog NumberACM765910734

CAS Number765910-73-4

CategoryBattery Materials; Electronic Materials

1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate

Synonyms

1-Butyl-2,3-dimethylimidazolium Triflate

IUPAC Name

1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate

Molecular Weight

302.31

Molecular Formula

C10H17F3N2O3S

Canonical SMILES

CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

1S/C9H17N2.CHF3O3S/c1-4-5-6-11-8-7-10(3)9(11)2;2-1(3,4)8(5,6)7/h7-8H,4-6H2,1-3H3;(H,5,6,7)/q+1;/p-1

InChI Key

KSOGGGZFEJTGPZ-UHFFFAOYSA-M

Melting Point

44 °C

Purity

>98.0%(HPLC)(N)

Solubility

soluble in Methanol

Appearance

White to Almost white powder to crystal

Storage

Store under inert gas

Chemical Formula

BDMIMOTF

Complexity

259

Covalently-Bonded Unit Count

Exact Mass

302.091198g/mol

Formal Charge

Hazard Statements

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

Heavy Atom Count

MDL Number

MFCD03427624

Monoisotopic Mass

302.091198g/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

1.55

Rotatable Bond Count

Signal Word

Warning

Specific Gravity

1.12

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