CAS 693-98-1 2-Methylimidazole - Materials / Alfa Chemistry

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2-Methylimidazole

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Catalog Number

ACM693981

Product Name

2-Methylimidazole

Structure

CAS

693-98-1

Category

Hydrogen Storage Materials

Synonyms

2-Methylglyoxaline

Description

DryPowder; OtherSolid

IUPAC Name

2-methyl-1H-imidazole

Molecular Weight

82.11

Molecular Formula

C4H6N2

Canonical SMILES

CC1=NC=CN1

InChI

1S/C4H6N2/c1-4-5-2-3-6-4/h2-3H,1H3,(H,5,6)

InChI Key

LXBGSDVWAMZHDD-UHFFFAOYSA-N

Boiling Point

267.0 °C;267 °C

Melting Point

144 °C

Purity

99%

Density

1.062 g/cm³

Solubility

Very soluble in ethanol;In water, 8.09X10+4 mg/L at 25 °C (est)

Appearance

White to Almost white powder to crystal

Storage

Store under inert gas, 2-8℃

Color/Form

Solid

Complexity

44.8

Covalently-Bonded Unit Count

EC Number

211-765-7

Exact Mass

82.053098g/mol

Formal Charge

Hazard Statements

H302 : Harmful if swallowed.H314 : Causes severe skin burns and eye damage.H360 : May damage fertility or the unborn child.H371 : May cause damage to organs.H373 : May cause damage to organs through prolonged or repeated exposure.H341 : Suspected of causing genetic defects.H351 : Suspected of causing cancer.

Heavy Atom Count

Log P

0.24 (LogP);log Kow = 0.24

MDL Number

MFCD00005190

MeSH Entry Terms

2-methylimidazole;2-methylimidazole hydrochloride;2-methylimidazole, silver (1+) salt;Zn(2-methylimidazole)2

Monoisotopic Mass

82.053098g/mol

NSC Number

21394

Other Experimental

Henry's Law constant = 4.14X10-6 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 9.41X10-11 cu cm/molec-sec at 25 °C (est)

Precautionary Statements

P501 : Dispose of contents/ container to an approved waste disposal plant.P260 : Do not breathe dust/ fume/ gas/ mist/ vapors/ spray.P270 : Do not eat, drink or smoke when using this product.P202 : Do not handle until all safety precautions have been read and understood.P201 : Obtain special instructions before use.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P308 + P313 : IF exposed or concerned: Get medical advice/ attention.P308 + P311 : IF exposed or concerned: Call a POISON CENTER/doctor.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.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.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.P405 : Store locked up.

Refractive Index

1.62

Rotatable Bond Count

Signal Word

Danger

Specific Gravity

1.16

UNII

T0049Z45LZ

Vapor Pressure

6.9X10-4 mm Hg at 25 °C (est)

XLogP3