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ジベンゾ[def,mno]クリセン

Anthanthrene

HCID 9118
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
部分構造検索類似構造を探す

基本情報

CAS
191-26-4
標準SMILES
c1cc2ccc3cc4cccc5ccc6cc(c1)c2c3c6c54
InChIKey
YFIJJNAKSZUOLT-UHFFFAOYSA-N
分子式
C22H12
平均分子量
276.3 g/mol
単同位体質量
276.09390038

概要

Anthanthrene is an ortho- and peri-fused polycyclic arene.

名称と識別子

優先名称
Anthanthrene
IUPAC
hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaene
現地名
ジベンゾ[def,mno]クリセン
英語名
ANTHANTHRENE
分子式
C22H12
分子量
276.33

名称と別名

Anthanthrene191-26-4Dibenzo[def,mno]chryseneAnthanthrenAnthranthreneDibenzo(cd,jk)pyreneDIBENZO(DEF,MNO)CHRYSENEDibenzo[cd,jk]pyreneL65OZG189HDTXSID9075452RefChem:112988DTXCID9036010
名称をさらに表示
ジベンゾ[def,mno]クリセンアンタントレンアンタントレン標準品アンサントレンアンタントレン, IN TOLUENE (200ΜG/ML)アンタントレン (50ΜG/ML トルエン溶液)ヘキサシクロ[11.7.1.14,20.02,11.03,8.017,21]ドコサ-1(21),2,4,6,8,10,12,14,16,18,20(22)-ウンデカエンBrn 2052392anthanthrene(purity)Anthanthrene solution
205-884-3hexacyclo(11.7.1.14,20.02,11.03,8.017,21)docosa-1(20),2,4(22),5,7,9,11,13,15,17(21),18-undecaeneNaphtho[7,8,1,2,3-nopqr]tetrapheneANTHANTHRENE (purity)hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaeneAnthanthren [German]CCRIS 48EINECS 205-884-3

データベース識別子

CAS
191-26-4

物性

構造計算による物性

XLogP
6.7
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
0
回転可能結合数
0
重原子数
22
形式電荷
0
複雑度
411

実験および物理化学的性質

PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
SpringerMaterials PropertiesAngular frequency
LogP7.04
Physical DescriptionGolden-yellow, odorless solid; [CHEMINFO] Golden-yellow crystalline solid; [MSDSonline]

物理化学的性質

融点
257.75 °C · 257.75°C
沸点
354.24 °C · 354.24°C (rough estimate)
比重(密度)
1.1847 · 1.1847 (estimate)
屈折率
1.98 · 1.9800 (estimate)
闪点
6 °C · 6 °C
貯蔵温度
2 · 2-8°C
色
6 H6 · C6H6 の黄金色のプレート
BRN
2052392 · 2052392
EPAの化学物質情報
Anthanthrene (191-26-4)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 5.6% (3 of 54) of reports.

Danger

H315 (72.2%): Causes skin irritation [Warning Skin corrosion/irritation]

P203, P264, P280, P302+P352, P318, P321, P332+P317, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 54 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazards SummaryMay cause irritation and photosensitization; [MSDSonline] Danger of cutaneous absorption; [MAK] See POLYCYCLIC AROMATIC HYDROCARBONS.
Hazard Classes and CategoriesSkin Irrit. 2 (72.2%)

毒性情報

TreatmentThere is no know antidote for PAHs. Exposure is usually handled with symptomatic treatment. (L10)
Health EffectsPAHs are carcinogens and have been associated with the increased risk of skin, respiratory tract, bladder, stomach, and kidney cancers. They may also cause reproductive effects and depress the immune system. (L10)
Adverse EffectsDermatotoxin - PICD (photoirritant contact dermatitis).
Exposure RoutesOral (L10) ; inhalation (L10)
Toxicity Summary · 1 件

The ability of PAH's to bind to blood proteins such as albumin allows them to be transported throughout the body. Many PAH's induce the expression of cytochrome P450 enzymes, especially CYP1A1, CYP1A2, and CYP1B1, by binding to the aryl hydrocarbon receptor or glycine N-methyltransferase protein. These enzymes metabolize PAH's into their toxic intermediates. The reactive metabolites of PAHs (epoxide intermediates, dihydrodiols, phenols, quinones, and their various combinations) covalently bind to DNA and other cellular macromolecules, initiating mutagenesis and carcinogenesis. (L10, L23, A27, A32)

化学と産業

薬理情報

Metabolism/Metabolites · 1 件

PAH metabolism occurs in all tissues, usually by cytochrome P-450 and its associated enzymes. PAHs are metabolized into reactive intermediates, which include epoxide intermediates, dihydrodiols, phenols, quinones, and their various combinations. The phenols, quinones, and dihydrodiols can all be conjugated to glucuronides and sulfate esters; the quinones also form glutathione conjugates. (L10)

用途と製造

Uses · 2 件

Used as a research chemical; Present in fossil fuels, coal tar, cigarette smoke, coal smoke, gasoline engine exhaust, high-protein foods, barbecue smoke, charcoal-broiled meats, vegetable oils and fats, sewage sludge, dried lake sediments, various lubricating oils, used motor oils, and urban air; [CHEMINFO]

PAHs are released into the environment via the combustion of fossil fuels, coke oven emissions and vehicle exhausts, as well as naturally from forest fires and vocanic eruptions. PAHs from these sources may contaminate nearly water systems. They are also found in coal tar and charbroiled food. (L10)

上流・下流製品情報

上流原料

コロネン1-メチレン-1H-インデンインデン

サプライヤー11 社

梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Xuzhou B&C Chemical Technology Co., Ltd

関連反応

0 件
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化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
PubChem CID
9118
DTXSID
DTXSID9075452
ChEBI
CHEBI:82389
UNII
L65OZG189H
EC Number
205-884-3
Nikkaji
J6.131J
Signs and SymptomsAcute exposure to PAHs causes irritation and inflammation of the skin and lung tissue. (A10)
Carcinogen Classification · 6 件

Anthanthrene

Group 3: Not classifiable as to its carcinogenicity to humans

Volume 92: (2010) Some Non-heterocyclic Polycyclic Aromatic Hydrocarbons and Some Related Exposures

2010

2005

3, not classifiable as to its carcinogenicity to humans. (L135)

安全データ

wgk
3
rtecs
HO5900000
ridadr
2811
毒性
mma-sat 1 mg/plate MUREAV 51,311,78
risk_code
11-38-48/20-63-65-67
hazard_code
F,Xn,Xi
safety_code
36/37-62
hazard_class
6.1(b)
packing_group
III
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