591882

(3R)-(−)-3-(1-Methyl-1H-indol-3-yl)butyraldehyde

98%

• Empirical Formula (Hill Notation): C₁₃H₁₅NO
• CAS Number: 405873-05-4
• Molecular Weight: 201.26
• MDL number: MFCD05664285
• UNSPSC Code: 12352005
• PubChem Substance ID: 24881358
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: 98%
• optical activity: [α]20/D -6, c = 1% in chloroform
• optical purity: ee: 99% (HPLC)
• mp: 55.5-59.5 °C (lit.)
• functional group: aldehyde
• SMILES string: C[C@H](CC=O)c1cn(C)c2ccccc12
• InChI: 1S/C13H15NO/c1-10(7-8-15)12-9-14(2)13-6-4-3-5-11(12)13/h3-6,8-10H,7H2,1-2H3/t10-/m1/s1
• InChI key: OQWWHYBHQFZHLP-SNVBAGLBSA-N

Description

Application

(3R)-(−)-3-(1-Methyl-1H-indol-3-yl)butyraldehyde can be used as a substrate in the synthesis of 2-alkyl cyclohexanone intermediates, applicable in the preparation of tricyclic steroid precursors.

Safety Information

• Pictograms: GHS06
• Signal Word: Danger
• Hazard Statements: H301,H315,H319,H335
• Precautionary Statements: P261 - P301 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 3 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves