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3-Amino-9-ethylcarbazole

HCID 8588
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인쇄 미리보기
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
132-32-1
표준 SMILES
CCn1c2ccccc2c2cc(N)ccc21
InChIKey
OXEUETBFKVCRNP-UHFFFAOYSA-N
분자식
C14H14N2
평균 분자량
210.27 g/mol
단동위원소 질량
210.11569845

개요

3-amino-9-ethylcarbazole is a tan powder. (NTP, 1992)

이름 및 식별자

우선 이름
3-Amino-9-ethylcarbazole
IUPAC
9-ethylcarbazol-3-amine
영어명
3-Amino-9-ethylcarbazole
분자식
C14H14N2
분자량
210.27

이름 및 동의어

3-AMINO-9-ETHYLCARBAZOLE132-32-19-Ethyl-9H-carbazol-3-amine3-Amino-N-ethylcarbazole9H-Carbazol-3-amine, 9-ethyl-Carbazole, 3-amino-9-ethyl-DTXSID10303198Q2BG27JBU9-ethyl-3-carbazolamineNSC-67709DTXCID5055RefChem:497512
이름 더 보기
AEC3AC50XAEC BUFFERAKOS BBS-00003629TIMTEC-BB SBB000498
205-057-79-Ethylcarbazol-3-amineMFCD000049649-ethyl-9H-carbazol-3-ylamine9-ethylcarbazole-3-ylamineAEC, 50XEN300-20033WLN: T B656 HNJ DZ H2

데이터베이스 식별자

CAS
132-32-1
PubChem CID
8588
DTXSID
DTXSID1030319
ChEMBL
CHEMBL327035
ChEBI
CHEBI:122149
UNII
8Q2BG27JBU
EC Number
205-057-7
Nikkaji
J36.857A

물성

구조 계산 물성

XLogP
3
극성 표면적
31 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
1
무거운 원자 수
16
형식 전하
0
복잡도
253

실험 및 물리화학적 성질

PolymersNitrogen Compounds -> Amines, Polyaromatic
Color/FormCrystalline compound
Solubilityless than 1 mg/mL at 68 °F (NTP, 1992)
DecompositionWhen heated to decomposition it emits toxic fumes of /oxides of nitrogen/.
Melting Point · 2건

208 to 212 °F (NTP, 1992)

127 °C

Physical Description · 2건

3-amino-9-ethylcarbazole is a tan powder. (NTP, 1992)

Tan solid; [CAMEO] Powder or lumps; [MSDSonline]

물리화학적 성질

녹는점
85 · 85-88 °C(lit.)
끓는 점
355 C · 355C
밀도
1 · 1,15g/cm
굴절률
1.618 · 1.6180 (estimate)
저장 조건
2 · 2-8°C
용해도
클로로포름(소량으로 용해), 메탄올(약간 용해됨)
산도 계수 (pKa)
4.99 · 4.99±0.30(Predicted)
물리적 상태

안전 및 규제

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

GHS 분류

GHS Classification · 6건

Danger

H350: May cause cancer [Danger Carcinogenicity]

P203, P280, P318, P405, and P501 (click each P-code to see the statement)

Danger

H301 (81.5%): Toxic if swallowed [Danger Acute toxicity, oral]

P203, P264, P270, P280, P301+P316, P318, P321, P330, P405, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory Information · 2건

Hazard Traits - Carcinogenicity

9H-Carbazol-3-amine, 9-ethyl-: Does not have an individual approval but may be used under an appropriate group standard

DOT LabelPoison
Fire HazardsExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992)
Hazards SummaryOral LD50 (rats) = 144 mg/kg; [HSDB] An irritant; [MSDSonline] Could be carcinogenic for man but not conclusive because of insufficient data; [MAK]
Reactive GroupAmines, Aromatic
Special Reports · 1건

Bioassay of 3-Amino-9-ethylcarbizole hydrochloride for Possible Carcinogenicity (1978) Technical Rpt Series No. 93 DHEW Pub No. (NIH) 78-1337, U.S. Department of Health Education and Welfare, National Cancer Institute, Bethesda, MD 20014 /3-Amino-9-ethylcarbizole hydrochloride/

Reactivity Profile · 1건

3-AMINO-9-ETHYLCARBAZOLE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. May generate hydrogen, a flammable gas, in combination with strong reducing agents such as hydrides.

화학 및 산업

용도 및 제조

Uses · 2건

Used to make dyes and pigments; Also used as an indicator of peroxidase in cells and a biological stain; [HSDB]

CHEM INT FOR C.I. PIGMENT VIOLET 23 & DIRECT BLUE 108; HISTOCHEMICAL INDICATOR FOR ASSAYING PEROXIDASE; BIOLOGICAL STAIN

U.S. Production · 2건

(1977) PROBABLY GREATER THAN 4.54X10+6 GRAMS

(1979) PROBABLY GREATER THAN 2.27X10+6 GRAMS

General Manufacturing Information9H-Carbazol-3-amine, 9-ethyl-: ACTIVE

응용 분야

용도3-Amino-9-ethylcarbazole (AEC) has been used as a chromogen in immunohistochemistry to visualize the cells. It has also been used as a substrate in enzyme-linked immune absorbent spot (ELISpot).

일반 설명Tan powder.

제조 방법

Prepared by reducing 3-nitro-N-ethylcarbazole with sodium sulfide.

상·하류 제품 정보

상류 원료

포타슘터셔리부톡사이드암모니아수에틸알코올N,N-다이메틸폼아마이드황화나트륨옥살산디에틸카르바졸

관련 반응

172건
반응 기록 만들기
HRID 50604 반응식
HRID 50604반응물로uspto-grants-2004_03
HRID 222396 반응식
HRID 222396반응물로uspto-grants-2012_06
HRID 254974 반응식
HRID 254974반응물로uspto-grants-2011_01
HRID 335379 반응식
HRID 335379반응물로uspto-grants-2014_11
HRID 364916 반응식
HRID 364916반응물로uspto-grants-1986_08
HRID 421036 반응식
HRID 421036반응물로uspto-grants-2012_01
HRID 802492 반응식
HRID 802492반응물로Test data from https://doi.org/10.1039/C8SC04228D
HRID 922565 반응식
HRID 922565반응물로uspto-grants-2016_03
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화합물 노트

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더보기
새 노트새 반응견적 요청하기
태블릿 형태
색상
갈색에서 매우 어두운 갈색까지
BRN
174969 · 174969
InChI
InChI=1S/C14H14N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9H,2,15H2,1H3
InChIKey
OXEUETBFKVCRNP-UHFFFAOYSA-N
SMILES
N1(CC)C2=C(C=CC=C2)C2=C1C=CC(N)=C2
NIST
9 H-carbazol-3-amine, · 9H-carbazol-3-amine, 9-ethyl-(132-32-1)
EPA
3 · 3-Amino-9-ethylcarbazole (132-32-1)

화학적 성질

3-Amino-9-ethylcarbazole is a brownish or tannish powder and chunks. It is utilized for producing dyes and pigments, as well as serving as an indicator for peroxidase in cells and a biological stain.

Air and Water ReactionsInsoluble in water.
Hazard Classes and Categories · 4건

Acute Tox. 3 (81.5%)

Carcinogenicity - category 1B

Acute toxicity (Oral) - Category 3

Carc. 1B

안전 및 보호

Fire FightingExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
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, FIRST REMOVE ALL SOURCES OF IGNITION, then dampen the solid spill material with toluene, then transfer the dampened material to a suitable container. Use absorbent paper dampened with toluene to pick up any remaining material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent-wash all contaminated surfaces with toluene followed by washing 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.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
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 a combination filter cartridge, i.e. organic vapor/acid gas/HEPA (specific for organic vapors, HCl, acid gas, SO2 and a high efficiency particulate filter). (NTP, 1992)

독성 정보

Ongoing Test Status · 2건

The following link will take the user to the National Toxicology Program (NTP) Test Agent Search Results page, which tabulates all of the "Standard Toxicology & Carcinogenesis Studies", "Developmental Studies", and "Genetic Toxicity Studies" performed with this chemical. Clicking on the "Testing Status" link will take the user to the status (i.e., in review, in progress, in preparation, on test, completed, etc.) and results of all the studies that the NTP has done on this chemical. [http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.searchresults&searchterm=132-32-1]

The following link will take the user to the National Toxicology Program (NTP) Test Agent Search Results page, which tabulates all of the "Standard Toxicology & Carcinogenesis Studies", "Developmental Studies", and "Genetic Toxicity Studies" performed with this chemical. Clicking on the "Testing Status" link will take the user to the status (i.e., in review, in progress, in preparation, on test, completed, etc.) and results of all the studies that the NTP has done on this chemical. /3-Amino-9-ethylcarbazole hydrochloride/ [http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.searchresults&searchterm=6109-97-3]

Probable Routes of Human ExposurePlant workers engaged in the manufacture of this compound and its use in pigment manufacture. Laboratory workers using this material in colorimetric enzyme assays and as a biological stain.
National Toxicology Program Studies · 1건

A bioassay of 3-amino-9-ethylcarbazole hydrochloride for possible carcinogenicity was conducted by administering the test chemical in the feed to Fischer 344 rats and B6C3F1 mice. Both the free amine form and the hydrochloride salt were used. Groups of 50 rats of each sex and 50 mice of each sex were admin the test cmpd at one of two doses, either 800 or 2,000 ppm for the rats and either 800 or 1,200 ppm for mice, for 78 wk. The rats were then observed for an additional 26-29 wk, and mice for an additional 16-17 wk. Controls consisted of groups of 50 untreated rats of each sex and 50 untreated mice of each sex; separate controls were used for the groups of animals administered the different doses. All surviving rats were /sacrificed/ at 104-110 wk; all surviving mice were /sacrificed/ at 94-97 wk. ... Under the conditions of this bioassay, 3-amino-9-ethylcarbazole hydrochloride was carcinogenic for the liver, inducing hepatocellular carcinomas in Fischer 344 rats and B6C3F1 mice of both sexes. Other tumors induced in the rats were carcinomas or papillomas of the integumentary system in males, carcinomas of the Zymbal's gland of the ear in males and females, and adenocarcinomas of the uterus. Levels of Evidence of Carcinogenicity: Male Rats: Positive; Female Rats: Positive; Male Mice: Positive; Female Mice: Positive. /3-Amino-9-ethylcarbazole hydrochloride/

Non-Human Toxicity Values · 2건

LD50 Rat oral 144 mg/kg

LD50 Mouse ip 150 mg/kg

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
FE3590000
ridadr
UN 2811 6.1/PG 3
HS 번호
29339900
risk_code
25-36/37/38-40-23/24/25-45
hazard_code
T
safety_code
45-36/37/39-26-22-53
포장분류
III
위험 등급
6.1
기존화학 물질
KE-13566
Hazard Classifications
Acute Tox. 3 OralCarc. 1B
스토리지 클래스
6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
유해 물질 데이터
132-32-1(Hazardous Substances Data)
9-에틸-3-nitrocarbazole
염산
질산
아세트산(빙초산)
메틸알콜
철분
이미다졸-2-카르복스알데히드

하류 제품

REMASTRAL BLUE FFRL카르브아졸 디옥사진 바이올렛N4-(9-Ethyl-9H-carbazol-3-yl)-N2-(3-Morpholin-4-yl-propyl)-pyriMidine-2,4-diaMineDIRECT BLUE 1089H-카르바졸,9-에틸-3-요오도-
추가 설명 · 1건

정의ChEBI: 3-Amino-9-ethylcarbazole is a hydrochloride salt and free amine solid compound. It has been used to visualize the bound primary antibody by using a streptavidin method. It has also been used in visualizing tissue sections from tumour samples.