1-Methylcyclopentanol , 99% , 1462-03-9

CAS NO.：1462-03-9

Empirical Formula: C6H12O

Molecular Weight: 100.16

MDL number: MFCD00001364

EINECS: 215-963-4

PRODUCT Properties

• Melting point: 36-37 °C (lit.)
• Boiling point: 135-136 °C (lit.)
• Density: 0.904 g/mL at 25 °C (lit.)
• refractive index: 1.4429
• Flash point: 105 °F
• storage temp.: Sealed in dry,Room Temperature
• solubility: Chloroform, Methanol (Slightly)
• form: powder to lump
• pka: 15.38±0.20(Predicted)
• color: White to Almost white
• Dielectric constant: 6.9699999999999998
• InChI: 1S/C6H12O/c1-6(7)4-2-3-5-6/h7H,2-5H2,1H3
• InChIKey: CAKWRXVKWGUISE-UHFFFAOYSA-N
• SMILES: CC1(O)CCCC1
• LogP: 1.135 (est)
• CAS DataBase Reference: 1462-03-9(CAS DataBase Reference)
• NIST Chemistry Reference: Cyclopentanol, 1-methyl-(1462-03-9)

Description and Uses

1-Methylcyclopentanol is used as a reagent in the synthesis of cis-2,5-dicyanopyrrolidine inhibitors of dipeptidyl peptidase IV. It is also used in the preparation of Lomifylline (L470200) which is a methylxanthine analog that induces Ca2+-release from intracellular stores via the ryanodine receptor.

Safety

• Symbol(GHS): GHS02,GHS05,GHS07
• Signal word: Danger
• Hazard statements: H228-H302-H318
• Precautionary statements: P210-P240-P241-P280-P301+P312-P305+P351+P338
• PPE: Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
• Hazard Codes: F,Xi
• Risk Statements: 11-22-41
• Safety Statements: 26-39
• RIDADR: UN 1325 4.1/PG 2
• WGK Germany: 3
• HazardClass: 4.1
• PackingGroup: III
• HS Code: 29061990
• Storage Class: 4.1B - Flammable solid hazardous materials
• Hazard Classifications: Acute Tox. 4 Oral; Eye Dam. 1; Flam. Sol. 1
• Limited Quantities: 1.0 Kg (2.2 lbs)
• Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)