1-(4-Aminomethyl-benzyl)-pyrrolidin-2-one

Base Information

• Chemical Name: 1-(4-Aminomethyl-benzyl)-pyrrolidin-2-one
• CAS No.: 953752-30-2
• Molecular Formula: C12H16N2O
• Molecular Weight: 204.26824
• Hs Code.: 2933790090
• ChEMBL ID: CHEMBL4519549
• DSSTox Substance ID: DTXSID50588489
• Wikidata: Q82481182
• Mol file: 953752-30-2.mol

Synonyms:953752-30-2;1-(4-Aminomethyl-benzyl)-pyrrolidin-2-one;1-[4-(AMINOMETHYL)BENZYL]PYRROLIDIN-2-ONE;1-{[4-(aminomethyl)phenyl]methyl}pyrrolidin-2-one;1-[4-(aminomethyl)benzyl]-2-pyrrolidinone;1-[[4-(aminomethyl)phenyl]methyl]pyrrolidin-2-one;1-(4-(Aminomethyl)benzyl)pyrrolidin-2-one;1-([4-(AMINOMETHYL)PHENYL]METHYL)PYRROLIDIN-2-ONE;SCHEMBL3903106;CHEMBL4519549;DTXSID50588489;MFCD09733871;AKOS000139131;MCULE-3139661751;BS-36361;EN300-39146;G43178;1-[4-(aminomethyl)benzyl]pyrrolidin-2-one(SALTDATA: FREE)

Chemical Property of 1-(4-Aminomethyl-benzyl)-pyrrolidin-2-one

Chemical Property:

• Vapor Pressure: 5.87E-07mmHg at 25°C
• Boiling Point: 410.8°C at 760 mmHg
• Flash Point: 202.2°C
• PSA: 46.33000
• Density: 1.17g/cm³
• LogP: 1.90590
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 204.126263138
• Heavy Atom Count: 15
• Complexity: 222

Purity/Quality:

98%min ^*data from raw suppliers

1-{[4-(aminomethyl)phenyl]methyl}pyrrolidin-2-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)N(C1)CC2=CC=C(C=C2)CN