3,5-Dibromobenzyl alcohol

Base Information

• Chemical Name: 3,5-Dibromobenzyl alcohol
• CAS No.: 145691-59-4
• Molecular Formula: C7H6Br2O
• Molecular Weight: 265.932
• Hs Code.: 2906299090
• European Community (EC) Number: 642-519-0
• DSSTox Substance ID: DTXSID10426555
• Nikkaji Number: J1.353.994D
• Wikidata: Q72463903
• Mol file: 145691-59-4.mol

Synonyms:3,5-Dibromobenzyl alcohol;145691-59-4;(3,5-Dibromophenyl)Methanol;Benzenemethanol, 3,5-dibromo-;3,5-Dibromobenzylalcohol;MFCD01632143;3,5-dibromo-benzyl alcohol;SCHEMBL112048;AMY3499;DTXSID10426555;ZQNSHKZQTZSNTB-UHFFFAOYSA-N;1,3-Dibromo-5-hydroxymethylbenzene;CK1125;AKOS005257972;CS-W006384;DS-6116;AC-26183;SY101056;FT-0614512;A22378;EN300-1707308;cis-4,7,10,13,16,19-Docosahexaenoicacidmethylester

Chemical Property of 3,5-Dibromobenzyl alcohol

Chemical Property:

• Vapor Pressure: 7.93E-05mmHg at 25°C
• Melting Point: 107-108 °C
• Refractive Index: 1.627
• Boiling Point: 327.9 °C at 760 mmHg
• PKA: 13.98±0.10(Predicted)
• Flash Point: 152.1 °C
• PSA: 20.23000
• Density: 1.96 g/cm³
• LogP: 2.70390
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility.: Slightly soluble in water.
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 265.87649
• Heavy Atom Count: 10
• Complexity: 97.8

Purity/Quality:

98%,99%, ^*data from raw suppliers

3,5-DibromobenzylAlcohol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C=C1Br)Br)CO
• Uses: It is used in the synthesis of substituted benzylamines.

Technology Process of 3,5-Dibromobenzyl alcohol

There total 8 articles about 3,5-Dibromobenzyl alcohol 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%

3,5-dibromobenzaldehyde (56990-02-4) → (3,5-dibromophenyl)methanol (145691-59-4)

Guidance literature:

With sodium tetrahydroborate; In ethanol; dichloromethane; at 20 ℃; for 3h;

DOI:10.1002/chem.201102260

Reference yield: 94.0%

3,5-dibromobenzoic acid (618-58-6) → (3,5-dibromophenyl)methanol (145691-59-4)

Guidance literature:

With dimethylsulfide borane complex; In tetrahydrofuran; at 0 - 20 ℃;

Reference yield: 87.0%

3,5-dibromobenzoic acid ethyl ester (67973-33-5) → (3,5-dibromophenyl)methanol (145691-59-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; at 20 ℃; Inert atmosphere; Schlenk techniques;

DOI:10.1002/ejoc.200900263

upstream raw materials:

3,5-dibromobenzyl bromide

3,5-dibromobenzaldehyde

3,5-dibromobenzoic acid

1,3,5-trisbromobenzene

Downstream raw materials:

1,3-Dibromo-5-(methoxymethoxymethyl)benzene

tert-butyl((3,5-dibromobenzyl)oxy)dimethyl silane

1,3-dibromo-5-ethoxymethyl-benzene

methyl 3,5-dibromobenzoate

Refernces

• 1、 Cardinali, Francois,Mamlouk, Hind,Rio, Yannick,Armaroli, Nicola,Nierengarten, Jean-Francois. "Fullerohelicates: A new class of fullerene-containing supermolecules". . p. 1582 - 1583. Retrieved 2004.
• 2、 Yoon, Seung Hee,Shin, Jicheol,Um, Hyun Ah,Lee, Tae Wan,Cho, Min Ju,Kim, Yong Jae,Son, Young Hoon,Yang, Joong Hwan,Chae, Geesung,Kwon, Jang Hyuk,Choi, Dong Hoon. "Novel 9,9′-(1,3-phenylene)bis-9H-carbazole-containing copolymers as hole-transporting and host materials for blue phosphorescent polymer light-emitting diodes". . p. 707 - 718. Retrieved 2014/02/14.