4-(Azetidinomethyl)phenyl cyclopropyl ketone

Base Information

• Chemical Name: 4-(Azetidinomethyl)phenyl cyclopropyl ketone
• CAS No.: 898757-10-3
• Molecular Formula: C14H17NO
• Molecular Weight: 215.29
• DSSTox Substance ID: DTXSID70642830
• Wikidata: Q82553986
• Mol file: 898757-10-3.mol

Synonyms:898757-10-3;4-(azetidinomethyl)phenyl cyclopropyl ketone;(4-(Azetidin-1-ylmethyl)phenyl)(cyclopropyl)methanone;[4-(azetidin-1-ylmethyl)phenyl]-cyclopropylmethanone;MFCD03841600;DTXSID70642830;AKOS016020292;SB51089;{4-[(Azetidin-1-yl)methyl]phenyl}(cyclopropyl)methanone;1-[(4-CYCLOPROPANECARBONYLPHENYL)METHYL]AZETIDINE

Chemical Property of 4-(Azetidinomethyl)phenyl cyclopropyl ketone

Chemical Property:

• Vapor Pressure: 9.31E-05mmHg at 25°C
• PKA: 8.04±0.10(Predicted)
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 215.131014166
• Heavy Atom Count: 16
• Complexity: 260

Purity/Quality:

97% ^*data from raw suppliers

4-(azetidinomethyl)phenylcyclopropylketone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CN(C1)CC2=CC=C(C=C2)C(=O)C3CC3