4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene

Base Information

Chemical Name:4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene
CAS No.:28622-84-6
Molecular Formula:C₂₀H₁₄O₂
Molecular Weight:286.33
Hs Code.:2906299090
DSSTox Substance ID:DTXSID40951289
Nikkaji Number:J36.053H
Mol file:28622-84-6.mol

Synonyms:4,5-dihydro-4,5-dihydroxybenzo(a)pyrene;4,5-dihydrobenzo(a)pyrene-4,5-trans-(e,e)-diol;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (4R-cis)-isomer;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (4R-trans)-isomer;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (4S-cis)-isomer;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (4S-trans)-isomer;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (cis)-isomer;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (trans)-(+-)-isomer;4,5-dihydroxy-4,5-dihydrobenzo(a)pyrene, (trans)-isomer;B(a)P-4,5-diol;benzo(a)pyrene-4,5-dihydrodiol

Suppliers and Price of 4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene

Chemical Property:

Vapor Pressure:1.09E-13mmHg at 25°C
Refractive Index:1.7580 (estimate)
Boiling Point:566.9°Cat760mmHg
Flash Point:275.5°C
PSA：40.46000
Density:1.452g/cm³
LogP:4.22660
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:286.099379685
Heavy Atom Count:22
Complexity:435

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C3=C4C(=CC2=C1)C(C(C5=CC=CC(=C54)C=C3)O)O

Technology Process of 4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene

There total 6 articles about 4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene 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: 78.0%

: 42286-46-4
benzo<α>pyrene-4,5-dione

: 28622-84-6,37571-88-3,50700-50-0,51689-89-5,62600-10-6,64474-18-6,72040-28-9,72040-29-0,72040-30-3
4,5-dihydrobenzo pyrene-4,5-trans-(e,e)-diol

Guidance literature:: With sodium tetrahydroborate; oxygen; In ethanol; for 24h; Ambient temperature;
DOI:10.1055/s-1982-29834

Reference yield:

: 37574-47-3,72010-12-9,72010-13-0
4,5-dihydro(epoxy) benzo pyrene

: 24027-84-7
5-hydroxy-benzo[a]pyrene

: 37574-48-4
4-hydroxybenzo anthracene

: 28622-84-6,37571-88-3,50700-50-0,51689-89-5,62600-10-6,64474-18-6,72040-28-9,72040-29-0,72040-30-3
4,5-dihydrobenzo pyrene-4,5-trans-(e,e)-diol

Guidance literature:: With ethylenediaminetetraacetic acid; tris hydrochloride; In sodium hydroxide; at 23 ℃; pH=7.3; Kinetics;
DOI:10.1021/tx960134j

Reference yield:

: 37574-47-3,72010-12-9,72010-13-0
4,5-dihydro(epoxy) benzo pyrene

calf thymus desoxyribonucleic acid: calf thymus desoxyribonucleic acid

: 24027-84-7
5-hydroxy-benzo[a]pyrene

: 37574-48-4
4-hydroxybenzo anthracene

: 28622-84-6,37571-88-3,50700-50-0,51689-89-5,62600-10-6,64474-18-6,72040-28-9,72040-29-0,72040-30-3
4,5-dihydrobenzo pyrene-4,5-trans-(e,e)-diol

: 2-(4-Hydroxy-4,5-dihydro-benzo[def]chrysen-5-ylamino)-9-((2R,4S,5R)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1,9-dihydro-purin-6-one

Guidance literature:: With sodium hydroxide; ethylenediaminetetraacetic acid; tris hydrochloride; at 23 ℃; pH=7.3; Kinetics;
DOI:10.1021/tx960134j