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Fuberidazole

HCID 19756
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
3878-19-1
표준 SMILES
c1coc(-c2nc3ccccc3[nH]2)c1
InChIKey
UYJUZNLFJAWNEZ-UHFFFAOYSA-N
분자식
C11H8N2O
평균 분자량
184.19 g/mol
단동위원소 질량
184.06366288

개요

Fuberidazole is a crystalline powder. Used in cereal seed dressing and fungicidal non-mercurial seed dressing with special action against fusarium. Not registered as a pesticide in the U.S. (EPA, 1998)

이름 및 식별자

우선 이름
Fuberidazole
IUPAC
2-(furan-2-yl)-1H-benzimidazole
영어명
FUBERIDAZOLE
분자식
C11H8N2O
분자량
184.19

이름 및 동의어

FUBERIDAZOLE3878-19-1FuberidatolFubridazoleFuridazolVoronit1H-Benzimidazole, 2-(2-furanyl)-FuberidazolFuridazole2-(2-Furyl)benzimidazoleFuberisazolVoronite
이름 더 보기
2-(furan-2-yl)-1H-benzo[d]iMidazolePF 7402bay33172wvii/117NSC 72670
2-(2-Furyl)-1H-benzimidazoleBayer 331722-(2-Furanyl)-1H-benzimidazoleBenzimidazole, 2-(2-furyl)-BAY 33172W VII/117B-33172DTXSID4041995

데이터베이스 식별자

CAS
3878-19-1
PubChem CID
19756
DTXSID
DTXSID4041995
ChEMBL
CHEMBL201094
ChEBI
CHEBI:81926
UNII
RXD450F6C7
EC Number
223-404-0
Nikkaji
J2.201B

물성

구조 계산 물성

XLogP
2.2
극성 표면적
41.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
14
형식 전하
0
복잡도
209

실험 및 물리화학적 성질

Pesticides · 3건

Fungicides

Active substance -> EU Pesticides database: Not approved

Environmental transformation -> Pesticides (parent, predecessor)

LogP2.67
Human DrugsPharmaceuticals
Melting Point · 2건

536 to 550 °F decomposes (EPA, 1998)

286 °C

Vapor Pressure0.00001 [mm Hg] @25 °C
Physical DescriptionFuberidazole is a crystalline powder. Used in cereal seed dressing and fungicidal non-mercurial seed dressing with special action against fusarium. Not registered as a pesticide in the U.S. (EPA, 1998)
Collision Cross Section138.0 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID4041995]

물리화학적 성질

녹는점
310 · 310-312℃
끓는 점
318.14 °C · 318.14°C (rough estimate)
밀도

안전 및 규제

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

GHS 분류

GHS Classification · 6건

Warning

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P203, P260, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P318, P319, P321, P330, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P260, P261, P262, P264, P270, P271, P272, P273, P280, P284, P301+P317, P302+P352, P304+P340, P316, P318, P319, P320, P321, P330, P333+P317, P361+P364, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory Information · 4건

Commission Regulation (EC) No 1490/2002

2008/108, Reg. (EU) 2022/801, Reg. (EU) No 540/2011

Fuberidazole: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelPoison
Fire HazardsWhen heated to decomposition, it emits toxic fumes of nitrogen oxides. (EPA, 1998)
Health HazardsIt is classified as moderately toxic. Its probable oral lethal dose in humans is 0.5-5 g/kg or between 1 ounce and 1 pint for a150 lb. person. (EPA, 1998)
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1건

FUBERIDAZOLE is a benzimidazole and behaves as an amine. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides

화학 및 산업

용도 및 제조

Use Classification · 2건

Pharmaceuticals

Environmental transformation -> Pesticides (parent, predecessor)

응용 분야

용도Fuberidazole is a benzimidazole based fungicide used as a fungicidal seed treatment of barley.

일반 설명Crystalline powder. Used in cereal seed dressing and fungicidal non-mercurial seed dressing with special action against fusarium. Not registered as a pesticide in the U.S.

상·하류 제품 정보

상류 원료

Glass-lined reaction pot중아황산나트륨SodiumhydroxymethylenesulfonateO-페닐렌다이아민1H-Benzimidazole, 2-(2-furanyl)-1-(2-furanylmethyl)-Benzenamine, N-(2-furanylmethylene)-알파-푸르푸릴리덴-알파-푸릴메틸아민2-(브로모메틸)푸란2-FURALDEHYDE옥심디니트로 벤젠퍼퓨릴 알코올

관련 반응

1건
반응 기록 만들기
HRID 869516 반응식
HRID 869516반응물로uspto-grants-2015_03

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
1.182 · 1.1820 (rough estimate)
증기압
-3 Pa · -3Pa (20 °C)
굴절률
1.53 · 1.5300 (estimate)
저장 조건
0 · 0-6°C
용해도
DMSO(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa)
4.6 · 4.6 (base)
수용성
200 mg · 200 mg l-1 (pH 4), 71 mg l-1 (pH 7) at 20 °C
물리적 상태
Solid
색상
미색부터 페일 베이지까지
BRN
153833 · 153833
Henry's Law Constant
1.9 · 1.9×105 mol/(m3Pa) at 25℃, Ebert et al. (2023)
주요 응용
농업환경
InChI
1S/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)
InChIKey
UYJUZNLFJAWNEZ-UHFFFAOYSA-N
SMILES
c1ccc2[nH]c(nc2c1)-c3ccco3
LogP
2.67 · 2.670
EPA
Fuberidazole (3878-19-1)

화학적 성질

Fuberidazole is a crystalline powder.

Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and Categories · 3건

Acute Tox. 4 (100%)

Carcinogenicity - category 2

Carc. 2

안전 및 보호

Fire Fighting · 1건

This compound is a fungicide. Move container from fire area if you can do so without risk. Fight fire from maximum distance. Dike fire control water for later disposal; do not scatter the material. Keep unnecessary people away; isolate hazard area and deny entry. Stay upwind; keep out of low areas. Ventilate closed spaces before entering them. Wear positive pressure breathing apparatus and special protective clothing. Remove and isolate contaminated clothing at the site.

First AidNote: No information on specific clinical effects of exposure was available.
Nonfire Spill ResponseThis compound is a fungicide. Do not touch spilled material; stop leak if you can do so without risk. Use water spray to reduce vapors.
Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Protective Action Criteria (PAC) · 3건

0.30 [mg/m3]

3.3 [mg/m3]

15 [mg/m3]

Personal Protective Equipment (PPE) · 1건

For emergency situations, wear a positive pressure, pressure-demand, full facepiece self-contained breathing apparatus (SCBA) or pressure- demand supplied air respirator with escape SCBA and a fully-encapsulating, chemical resistant suit. (EPA, 1998)

안전 데이터

wgk
3
rtecs
DD9010000
ridadr
2588
HS 번호
29339900
risk_code
22-50/53-23-21-48/22-43-40-21/22
hazard_code
Xn,N,T
safety_code
22-60-61-45-36/37
포장분류
III
위험 등급
6.1(b)
Hazard Classifications
Acute Tox. 2 InhalationAcute Tox. 3 DermalAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Carc. 2 InhalationSkin Sens. 1STOT RE 2
스토리지 클래스
6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
푸르푸릴아민
2-니트로아닐린
푸르푸랄

공급사59 곳

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湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
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Aladdin Scientific[email protected]
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Wuhan Topule Biopharmaceutical Co., Ltd+86-18327326525 · [email protected]
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SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
上海安谱实验科技股份有限公司18502138905 · [email protected]

추가 설명

정의ChEBI: A ring assembly consisting of benzimidazole substituted at position 2 by a 2-furyl group. A fungicide used as a seed treatment to control Fusarium spp. in cereals.