3-(Diethylamino)propanoic acid

Base Information

• Chemical Name: 3-(Diethylamino)propanoic acid
• CAS No.: 6972-41-4
• Molecular Formula: C7H15 N O2
• Molecular Weight: 145.202
• NSC Number: 61986
• DSSTox Substance ID: DTXSID20989883
• Nikkaji Number: J232.005C
• Mol file: 6972-41-4.mol

Synonyms:3-(diethylamino)propanoic acid;6972-41-4;N,N-Diethyl-beta-alanine;Propionic acid, 3-(diethylamino)-;3-(DIETHYLAMINO)PROPANOICACID;.beta.-Alanine, N,N-diethyl-;NSC61986;3-diethylaminopropionic acid;.beta.-Alanine,N-diethyl-;N,N-Diethyl-beta-alanine #;SCHEMBL105467;3-(diethylamino) propionic acid;DIOYEFVIHLBWJX-UHFFFAOYSA-;DTXSID20989883;ADAL1185316;BBL030473;MFCD06208042;NSC-61986;STK824605;AKOS005635429;3-diethylaminopropanoic acid hydrochloride;FT-0693674;InChI=1/C7H15NO2/c1-3-8(4-2)6-5-7(9)10/h3-6H2,1-2H3,(H,9,10)

Chemical Property of 3-(Diethylamino)propanoic acid

Chemical Property:

• Melting Point: 70-75 °C
• Boiling Point: 155 °C(Press: 0.2 Torr)
• PKA: 3.67±0.14(Predicted)
• PSA: 40.54000
• Density: 0.994±0.06 g/cm3(Predicted)
• LogP: 0.80290
• XLogP3: -1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 145.110278721
• Heavy Atom Count: 10
• Complexity: 99.8

Purity/Quality:

99% ^*data from raw suppliers

3-(DIETHYLAMINO)PROPANOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCC(=O)O

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