홈MCP워크벤치Skills
홈워크벤치알림마이페이지
Huagongshe 오픈 프로젝트:[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.8
  1. 홈
  2. /화합물

4-아세타미도플루오렌

4-Acetylaminofluorene

HCID 34210
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
28322-02-3
표준 SMILES
CC(=O)Nc1cccc2c1-c1ccccc1C2
InChIKey
PHPWISAFHNEMSR-UHFFFAOYSA-N
분자식
C15H13NO
평균 분자량
223.27 g/mol
단동위원소 질량
223.09971404

개요

N-(4-fluorenyl)acetamide is a light beige powder. (NTP, 1992)

이름 및 식별자

우선 이름
4-Acetylaminofluorene
IUPAC
N-(9H-fluoren-4-yl)acetamide
현지명
4-아세타미도플루오렌
영어명
4-Acetamidofluorene
분자식
C15H13NO
분자량
223.27

이름 및 동의어

4-ACETYLAMINOFLUORENE28322-02-34-Fluorenylacetamide4-AcetylaminofluorenN-Fluoren-4-ylacetamideAcetamide, N-fluoren-4-yl-N-4-FluorenylacetamideAcetamide, N-9H-fluoren-4-yl-4-AAFAcetamide, N-fluoren-4-ylAcetamide, N-9H-fluoren-4-ylU41BO8XU2Z
이름 더 보기
4-아세타미도플루오렌N-4-FluorenylN-4-ACETYLAMINOFLUORENEn-fluoren-4-yl-acetamid
DTXSID1020019NSC-9866CHEBI:76343RefChem:97636DTXCID9019248-964-34-AcetamidofluoreneN-(9H-Fluoren-4-yl)acetamide

데이터베이스 식별자

CAS
28322-02-3
PubChem CID
34210
DTXSID
DTXSID1020019
ChEMBL
CHEMBL2311070
ChEBI
CHEBI:76343
UNII
U41BO8XU2Z
EC Number
248-964-3
Nikkaji
J3.484C

물성

구조 계산 물성

XLogP
2.7
극성 표면적
29.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
1
무거운 원자 수
17
형식 전하
0
복잡도
301

실험 및 물리화학적 성질

PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
Solubilityless than 1 mg/mL at 68 °F (NTP, 1992)
DecompositionWhen heated to decomp it emits NO(x).
Melting Point390 to 392 °F (NTP, 1992)
Physical Description · 2건

N-(4-fluorenyl)acetamide is a light beige powder. (NTP, 1992)

Light beige solid; [CAMEO]

물리화학적 성질

녹는점
198 · 198-200°C
끓는 점
364.56 °C · 364.56°C (rough estimate)
밀도
1.0707 · 1.0707 (rough estimate)
굴절률
1.55 · 1.5500 (estimate)
산도 계수 (pKa)
14.87 · 14.87±0.20(Predicted)
EPA
4 · 4-Acetylaminofluorene (28322-02-3)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Warning

H315 (90.5%): Causes skin irritation [Warning Skin corrosion/irritation]

P203, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes of NOx. (NTP, 1992)
Hazards SummaryAn irritant; [MSDSonline] See 2-Acetylaminofluorene.
Reactive GroupAmides and Imides
Reactivity Profile · 1건

An amide. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).

Air and Water ReactionsInsoluble in water.
Toxic Combustion ProductsWhen heated to decomp it emits toxic fumes of NO(x).

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationSubstances that increase the risk of NEOPLASMS in humans or animals. Both genotoxic chemicals, which affect DNA directly, and nongenotoxic chemicals, which induce neoplasms by other mechanism, are included.

용도 및 제조

Uses · 2건

Used as a research chemical; Not commercially produced in the US; [HSDB]

RESEARCH CHEMICAL

U.S. Production(1977) NOT PRODUCED COMMERCIALLY IN USA

응용 분야

일반 설명Light beige powder.

공급사16 곳

郑州汇聚化工有限公司13393710386 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
苏州启航生物科技有限公司18151111370

관련 반응

0건
반응 기록 만들기

현재 필터 조건에 해당하는 반응 기록이 없습니다.

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
Hazard Classes and Categories
Skin Irrit. 2 (90.5%)

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If you spill this chemical, you should dampen the solid spill material with water, then transfer the dampened material to a suitable container. Use absorbent paper dampened with water to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Disposal Methods · 1건

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

독성 정보

Non-Human Toxicity Excerpts · 4건

4-ACETYLAMINOFLUORENE, ... WHEN FED TO MALE RATS (0.05% OF DIET), CAUSED PROLIFERATION OF AGRANULAR ENDOPLASMIC RETICULUM & GLYCOGEN DEPLETION IN HEPATOCYTES. NO OTHER CHANGES WERE OBSERVED AFTER 3-4 WK OF TREATMENT, APART FROM MINOR DEGREE OF INTRACELLULAR LIPID ACCUM. THESE EFFECTS PRODUCED BY 4-ACETYLAMINOFLUORENE WERE MARKEDLY DIFFERENT FROM THAT PRODUCED BY THE CARCINOGENIC ISOMER.

4-ACETYLAMINOFLUORENE FED TO MALE LEEDS RATS AT CONCN OF 0.05% OF DIET FOR UP TO 10 MO PRODUCED CONSPICUOUS MORPHOLOGICAL ALTERATIONS IN PANCREATIC GRANULAR ENDOPLASMIC RETICULUM TOGETHER WITH MITOCHONDRIAL DAMAGE & FOCAL CYTOPLASMIC DEGRADATION.

A DIET CONTAINING 0.05% 4-ACETYLAMINOFLUORENE (4-AAF) WAS FED TO MALE LEEDS RATS FOR PERIODS UP TO 10 MO. SOME ANIMALS WERE KILLED AFTER 12 WKS, 6 MO & 8-10 MO OF FEEDING, WHILE FURTHER GROUPS WERE RETURNED TO A NORMAL DIET AFTER 10 MO OF TREATMENT & THEN KILLED 2, 5, 9, & 12 MO LATER. THE MAIN FINE STRUCTURAL CHANGES INDUCED WERE PROMINENT HYPERTROPHY OF AGRANULAR ENDOPLASMIC RETICULUM, GLYCOGEN DEPLETION & LIPID ACCUM. THESE CHANGES PERSISTED FOLLOWING WITHDRAWAL OF DIETARY 4-ACETYLAMINOFLUORENE FOR THE DURATION OF THE EXPERIMENT.

A SHORT TERM MAMMALIAN CARCINOGENICITY TEST SYSTEM IS PRESENTED IN WHICH AN IN VIVO APPLICATION IN RATS IS FOLLOWED AFTER 2 WEEKS BY AN IN VITRO CULTURE OF THE PERITONEAL CELLS. 2-ACETYLAMINOFLUORENE PROVED POSITIVE & 4-ACETYLAMINOFLUORENE WAS NEGATIVE. BOTH ANALOGS WERE APPLIED AT A SINGLE ORAL DOSE OF 50 MG/KG. 2-ACETYLAMINOFLUORENE WAS ALSO POSITIVE AT A DOSE OF 25 MG/KG CORRESPONDING TO 2.5% OF THE HIGHEST TOLERATED DOSE OF THIS CARCINOGEN. A HIGH STRUCTURE-RELATED SPECIFICITY OF TEST SYSTEM IS SUGGESTED.

안전 데이터

ridadr
2811
독성
TD orl-rat: 5240 mg/kg/57W-C:ETA,REP JNCIAM 24,149,60
risk_code
23/24/25-46
safety_code
3/7-9-22-36/37/39-45
유해 물질 데이터
28322-02-3(Hazardous Substances Data)
上海遐瑞医药科技有限公司+86 21 61551611
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
湖北创联康成药物化学有限公司027-65388397 18164111589 · [email protected]
华阴市赛普生物科技有限公司13892502238 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
南京毕科生物科技有限公司025-58906079 17352406906 · [email protected]
Nanjing Bicbiotechnology Co., Ltd+86-2552131256 +86-18251840740 · [email protected]

추가 설명

정의ChEBI: A member of the class of acetamides that is acetamide in which one of the hydrogens attached to the nitrogen is replaced by a 9H-fluoren-4-yl group.