3-Methyl-4-(pyrrolidin-1-yl)benzaldehyde

Base Information

• Chemical Name: 3-Methyl-4-(pyrrolidin-1-yl)benzaldehyde
• CAS No.: 461033-80-7
• Molecular Formula: C12H15NO
• Molecular Weight: 189.25
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10389772
• Wikidata: Q82185907
• ChEMBL ID: CHEMBL5093301
• Mol file: 461033-80-7.mol

Synonyms:461033-80-7;3-methyl-4-(pyrrolidin-1-yl)benzaldehyde;3-Methyl-4-pyrrolidin-1-yl-benzaldehyde;3-methyl-4-pyrrolidin-1-ylbenzaldehyde;CHEMBL5093301;3-methyl-4-(1-pyrrolidinyl)benzaldehyde;SCHEMBL4079761;DTXSID10389772;BBL025795;BDBM50585947;MFCD03063768;STL371698;AKOS000112547;VS-08101;BB 0217741;CS-0072204;FT-0678679;EN300-265779;A872286;F9995-2639

Chemical Property of 3-Methyl-4-(pyrrolidin-1-yl)benzaldehyde

Chemical Property:

• Vapor Pressure: 9.11E-05mmHg at 25°C
• Boiling Point: 339.6°C at 760 mmHg
• Flash Point: 134.6°C
• PSA: 20.31000
• Density: 1.1g/cm³
• LogP: 2.47270
• Storage Temp.: 2-8°C
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 189.115364102
• Heavy Atom Count: 14
• Complexity: 199

Purity/Quality:

98%min ^*data from raw suppliers

3-Methyl-4-(pyrrolidin-1-yl)benzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)C=O)N2CCCC2