N-(Hydroxymethyl)benzamide

Base Information

• Chemical Name: N-(Hydroxymethyl)benzamide
• CAS No.: 6282-02-6
• Molecular Formula: C8H9NO2
• Molecular Weight: 151.165
• Hs Code.: 29242990
• European Community (EC) Number: 228-495-0
• NSC Number: 5946
• UNII: LF48FI2YOX
• DSSTox Substance ID: DTXSID80211930
• Nikkaji Number: J206.838I
• Wikidata: Q27452341
• Mol file: 6282-02-6.mol

Synonyms:N-(hydroxymethyl)-benzamide;N-hydroxymethylbenzamide

Chemical Property of N-(Hydroxymethyl)benzamide

Chemical Property:

• Appearance/Colour: white crystalline powder
• Vapor Pressure: 1.74E-06mmHg at 25°C
• Melting Point: 95-100 °C
• Refractive Index: 1.564
• Boiling Point: 381 °C at 760 mmHg
• PKA: 13.25±0.46(Predicted)
• Flash Point: 184.2 °C
• PSA: 49.33000
• Density: 1.187 g/cm³
• LogP: 0.75710
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: DMSO (Slightly), Water (Slightly)
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 151.063328530
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

99% ^*data from raw suppliers

N-(Hydroxymethyl)benzamide 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi
• Hazard Codes: Xn,Xi
• Statements: 22-36-36/37/38
• Safety Statements: 26-37/39-37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)NCO
• Uses: N-(Hydroxymethyl)benzamide (CAS# 6282-02-6) can be used to prepare high-dispersibilty disperse acidic dyes.

Technology Process of N-(Hydroxymethyl)benzamide

There total 13 articles about N-(Hydroxymethyl)benzamide 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: 96.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + benzamide (55-21-0,27208-38-4) → N-(hydroxymethyl)benzamide (6282-02-6)

Guidance literature:

With NaY zeolite; In water; at 100 ℃; for 1h; Reagent/catalyst; Time;

DOI:10.1016/j.catcom.2014.12.006

Reference yield: 84.0%

benzamide (55-21-0,27208-38-4) → N-(hydroxymethyl)benzamide (6282-02-6)

Guidance literature:

With formaldehyd;

Reference yield: 62.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + benzamide (55-21-0,27208-38-4) + m-xylene (108-38-3,104809-90-7) → N-(hydroxymethyl)benzamide (6282-02-6)

Guidance literature:

With water; at 100 ℃; for 10h; Reagent/catalyst; Sealed tube;

DOI:10.1016/j.catcom.2017.11.002

upstream raw materials:

formaldehyd

benzamide

triethylamine

N-<(phenylsulfenyl)methyl>benzamide

Downstream raw materials:

N-(2-methoxy-[1]naphthylmethyl)-benzamide

5-(benzoylamino-methyl)-furan-2-carboxylic acid

4-(benzoylamino-methyl)-thiophene-2-carboxylic acid

Bis-(2,2'-dichloroethyl)aminomethyl-benzoesaeureamid

Refernces

• 1、 Chevella, Durgaiah,Mameda, Naresh,Kodumuri, Srujana,Banothu, Rammurthy,Gajula, Krishna Sai,Kutepov, Boris Ivanovich,Nama, Narender. "Three-component synthesis of amidomethylarenes and -heteroarenes over HΒ zeolite under solvent-free conditions". . p. 20 - 25. Retrieved 2017/11/20.
• 2、 Schneider, Angelika E.,Manolikakes, Georg. "Bi(OTf)3-Catalyzed Multicomponent α-Amidoalkylation Reactions". . p. 6193 - 6212. Retrieved 2015/06/30.