Benzo(B)chrysene

Base Information

• Chemical Name: Benzo(B)chrysene
• CAS No.: 214-17-5
• Molecular Formula: C22H14
• Molecular Weight: 278.353
• Hs Code.: 2902909090
• European Community (EC) Number: 205-919-2
• NSC Number: 89274
• UNII: 6ON074YM4G
• DSSTox Substance ID: DTXSID80175664
• Nikkaji Number: J5.881E
• Wikidata: Q27155921
• Mol file: 214-17-5.mol

Synonyms:BENZO(B)CHRYSENE;Benzo[b]chrysene;214-17-5;Benzo[c]tetraphene;2,3-Benzochrysene;3,4-Benzotetracene;3,4-Benztetraphene;3,4-Benzotetraphene;1,2:6,7-Dibenzophenanthrene;Naphth(2,1-a)anthracene;Benzo(c)tetraphene;2,3:7,8-Dibenzophenanthrene;NSC 89274;6ON074YM4G;CCRIS 6760;EINECS 205-919-2;NSC-89274;BRN 2051199;pentacyclo[12.8.0.02,11.04,9.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene;2,3-Benzchrysene;1,7-Dibenzophenanthrene;2,8-Dibenzophenanthrene;UNII-6ON074YM4G;Dibenzo-2,7,8-phenanthrene;BENZO(B)CHRYSENE [IARC];Dibenzo-2,3,7,8-phenanthrene;CHEBI:82399;DTXSID80175664;NSC89274;LS-33704;Benzo[b]chrysene 100 microg/mL in Toluene;FT-0631873;Benzo[b]chrysene 10 microg/mL in Cyclohexane;benzo[b]chrysene,1,2:6,7-dibenzophenanthrene;Benzo[b]chrysene 10 microg/mL in Acetonitrile;C19339;4-05-00-02721 (Beilstein Handbook Reference);J-014042;Benzo[b]chrysene, BCR(R) certified Reference Material;Q27155921

Chemical Property of Benzo(B)chrysene

Chemical Property:

• Vapor Pressure: 1.41E-10mmHg at 25°C
• Melting Point: 293.85°C
• Refractive Index: 1.8120 (estimate)
• Boiling Point: 524.7°C at 760 mmHg
• Flash Point: 264.5°C
• PSA: 0.00000
• Density: 1.232g/cm³
• LogP: 6.29940
• Storage Temp.: 2-8°C
• XLogP3: 6.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 278.109550447
• Heavy Atom Count: 22
• Complexity: 399

Purity/Quality:

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

Benzo[b]chrysene BCR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC5=CC=CC=C5C=C43
• Uses: This compound is used in the rapid extraction method of polycyclic aromatic compounds in soil using basic silica selective pressurized liquid extraction.

Technology Process of Benzo(B)chrysene

There total 14 articles about Benzo(B)chrysene 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:

polyethylene → benzo[c]phenathrene (195-19-7) + 1-methylanthracene (610-48-0) + benzo[ghi]fluoranthene (203-12-3) + Benzo[b]chrysene (214-17-5)

Guidance literature:

With air; at 600 - 900 ℃; Further byproducts given; Formation of xenobiotics;

DOI:10.1016/S0045-6535(99)00054-5

Reference yield:

polyethylene → 3,4-dihydrocyclopentapyrene (25732-74-5) + 4H-Cyclopenta[def]phenanthrene (203-64-5) + cyclopenta[c,d]pyrene (27208-37-3) + Benzo[b]chrysene (214-17-5)

Guidance literature:

With air; at 600 - 900 ℃; Further byproducts given; Formation of xenobiotics;

DOI:10.1016/S0045-6535(99)00054-5

Reference yield:

1-Methylnaphthalene (90-12-0,34475-76-8) → picene (213-46-7) + dibenzo[a,h]anthracene (53-70-3) + Benzo[b]chrysene (214-17-5) + dibenz[a,j]anthracene (224-41-9)

Guidance literature:

at 750 ℃;

upstream raw materials:

8,9,10,11-tetrahydro-benzo[b]chrysene

benzo[b]chrysene-7,12-dione

1-Methylnaphthalene

phenanthrene

Downstream raw materials:

Benzonaphtho<1,2,3,4-def>-chrysen

Refernces

• 1、 Clar,Clar. "". . p. 3267. Retrieved 1973.
• 2、 Spalletti, Anna,Bartocci, Giampiero,Elisei, Fausto,Mancini, Vittorio,Mazzucato, Ugo. "Temperature effects on the photoreactivity and rotamerism of (Z)-1-styrylanthracene in non-polar and polar solvents". . p. 211 - 219. Retrieved 2007/10/03.