3-(Benzylamino)propan-1-ol

Base Information

• Chemical Name: 3-(Benzylamino)propan-1-ol
• CAS No.: 4720-29-0
• Molecular Formula: C10H15NO
• Molecular Weight: 165.235
• Hs Code.: 2922199090
• European Community (EC) Number: 225-210-1
• NSC Number: 17283
• DSSTox Substance ID: DTXSID00197065
• Nikkaji Number: J154.821B
• Wikidata: Q72440658
• Mol file: 4720-29-0.mol

Synonyms:4720-29-0;3-(benzylamino)propan-1-ol;3-(Benzylamino)-1-propanol;N-BENZYL-3-AMINOPROPAN-1-OL;3-(Benzylamino)propanol;N-Benzyl-3-aminopropanol;3-BENZYLAMINO-1-PROPANOL;1-Propanol, 3-[(phenylmethyl)amino]-;N-Benzyl-3-amino-1-propanol;EINECS 225-210-1;MFCD00020622;1-Propanol, 3-((phenylmethyl)amino)-;NSC17283;NSC 17283;3-Benzylaminopropanol;3-(N-benzylamino)propanol;3-benzylamino-propan-1-ol;Cambridge id 5116282;5-Phenyl-4-azapentane-1-ol;SCHEMBL304695;N-(3-Hydroxypropyl)benzylamine;DTXSID00197065;NSC-17283;AKOS002657999;AC-7182;SB76329;AS-31242;SY004678;B3462;CS-0067773;FT-0601400;FT-0733608;A25696;EN300-111943;Z57079457

Chemical Property of 3-(Benzylamino)propan-1-ol

Chemical Property:

• Vapor Pressure: 0.000991mmHg at 25°C
• Refractive Index: 1.533
• Boiling Point: 289.8 °C at 760 mmHg
• PKA: 14.96±0.10(Predicted)
• Flash Point: 117.9 °C
• PSA: 32.26000
• Density: 1.022g/cm³
• LogP: 1.54950
• Storage Temp.: Refrigerator
• Solubility.: Chloroform, Dichloromethane, Ethyl Acetate
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 165.115364102
• Heavy Atom Count: 12
• Complexity: 100

Purity/Quality:

99% ^*data from raw suppliers

N-Benzyl-3-aminopropanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CNCCCO

Technology Process of 3-(Benzylamino)propan-1-ol

There total 37 articles about 3-(Benzylamino)propan-1-ol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

4-Aminobutanol (13325-10-5) + benzaldehyde (100-52-7) → 3-(benzylamino)propan-1-ol (4720-29-0)

Guidance literature:

4-Aminobutanol; benzaldehyde; In methanol; at 20 ℃; for 0.166667h;

With sodium tetrahydroborate; In methanol; at 0 - 20 ℃;

DOI:10.3762/bjoc.10.35

Reference yield: 100.0%

3-[N-benzyl-N-(tert-butoxycarbonyl)amino]propan-1-ol (98014-76-7) → 3-(benzylamino)propan-1-ol (4720-29-0)

Guidance literature:

With hydrogenchloride; for 19h;

DOI:10.1080/00397919508015894

Reference yield: 98.0%

benzaldehyde (100-52-7) + propan-1-ol-3-amine (156-87-6) → 3-(benzylamino)propan-1-ol (4720-29-0)

Guidance literature:

With methanol; sodium tetrahydroborate; at 20 ℃;

upstream raw materials:

benzaldehyde

propan-1-ol-3-amine

benzylamine

N-Benzyliden-3-hydroxy-1-propanamin

Downstream raw materials:

3-Benzyl-2-morpholin-4-yl-[1,3,2]oxazaphosphinane

3-benzyl-[1,2,3]oxathiazinane 2-oxide

(E)-2-Phenyl-ethenesulfonic acid benzyl-(3-hydroxyimino-propyl)-amide

(3-oxopropyl)-N-benzyl-2-phenylethene-1-sulfonamide

Refernces

• 1、 Chieffi, Gianpaolo,Braun, Max,Esposito, Davide. "Continuous reductive amination of biomass-derived molecules over carbonized filter paper-supported FeNi alloy". . p. 3590 - 3594. Retrieved 2015.
• 2、 -. "NOVEL HISTONE METHYLTRANSFERASE INHIBITORS". Page/Page column 30; 91-92. . Retrieved 2021/04/01.
• 3、 Sakata, Juri,Akita, Kazunari,Sato, Manabu,Shimomura, Masashi,Tokuyama, Hidetoshi. "Cyclic Sulfamidite as Simultaneous Protecting Group for Amino Alcohols: Development of a Mild Deprotection Protocol Using Thiophenol". . p. 996 - 1000. Retrieved 2020/11/03.