DIBENZO(A,I)PYRENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H14
Molecular Weight	302.368
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C1=CC2=CC3=C4C(C=CC5=C4C(C=C3)=CC6=CC=CC=C56)=C2C=C1

InChI

InChIKey=TUGYIJVAYAHHHM-UHFFFAOYSA-N

InChI=1S/C24H14/c1-3-7-19-15(5-1)13-17-9-10-18-14-16-6-2-4-8-20(16)22-12-11-21(19)23(17)24(18)22/h1-14H

HIDE SMILES / InChI

Molecular Formula	C24H14
Molecular Weight	302.368
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Tissue-specific in vivo genetic toxicity of nine polycyclic aromatic hydrocarbons assessed using the Muta™Mouse transgenic rodent assay.	2016-01-01	26603514
Polycyclic aromatic hydrocarbons: 15 Listings - benz[a]anthracene, benzo[b]fluoranthene, benzo[j]fluoranthene, benzo[k]fluoranthene, benzo[a]pyrene, dibenz[a,h]acridine, dibenz[a,j]acridine, dibenz[a,h]anthracene, 7H-dibenzo[c,g]carbazole, dibenzo[a,e]pyrene, dibenzo[a,h]pyrene, dibenzo[a,i]pyrene, dibenzo[a,l]pyrene, indeno[1,2,3-cd]pyrene, 5-methylchrysene.	2011	21863085
Base flipping free energy profiles for damaged and undamaged DNA.	2010-12-20	21090780
Naturally occurring food toxins.	2010-09	22069686
Rainbow trout (Oncorhynchus mykiss) and ultra-low dose cancer studies.	2009-03	19135172
RNA from brush oral cytology to measure squamous cell carcinoma gene expression.	2008-02	18197850
Determination of dibenzopyrenes in standard reference materials (SRM) 1649a, 1650, and 2975 using ultrasonically assisted extraction and LC-GC-MS.	2006-01	16333601
An approach to investigating the importance of high potency polycyclic aromatic hydrocarbons (PAHs) in the induction of lung cancer by air pollution.	2005-07	15833386
Direct determination of dibenzo[a,l]pyrene and its four dibenzopyrene isomers in water samples by solid-liquid extraction and laser-excited time-resolved Shpol'skii spectrometry.	2005-03-01	15732929
Laser-excited time-resolved Shpol'skii spectroscopy for the direct analysis of dibenzopyrene isomers in liquid chromatography fractions.	2004-12	15606949
The rainbow trout (Oncorhynchus mykiss) tumor model: recent applications in low-dose exposures to tumor initiators and promoters.	2003-02-25	12597433
Aryl hydrocarbon receptor-mediated activity of mutagenic polycyclic aromatic hydrocarbons determined using in vitro reporter gene assay.	2001-10-18	11525907

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:10:48 GMT 2025` Edited by `admin` on `Mon Mar 31 19:10:48 GMT 2025`
Record UNII	7FMI112D18
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-87521

Preferred Name

English

DIBENZO(A,I)PYRENE

Systematic Name

English

DIBENZO(A,I)PYRENE [IARC]

Common Name

English

BENZO(RST)PENTAPHENE

Systematic Name

English

1,2:7,8-DIBENZPYRENE

Common Name

English

3,4:9,10-DIBENZOPYRENE

Common Name

English

BENZO(RST)PENTACENE

Systematic Name

English

DIBENZO(A,I)PYRENE [HSDB]

Common Name

English

DB(A,I)P

Common Name

English

DIBENZO(B,H)PYRENE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID9059751