Proquinazid (HCID 11057771)

개요

Proquinazid is a member of the class of quinazolines that is quinazolin-4-one substituted at positions 2, 3 and 6 by propoxy, propyl and iodo groups respectively. A fungicide with the potential to control powdery mildew in a range of crops including cereals and grapes. It has a role as an antifungal agrochemical. It is an aromatic ether, an organoiodine compound and a member of quinazolines.

이름 및 식별자

우선 이름: Proquinazid
IUPAC: 6-iodo-2-propoxy-3-propylquinazolin-4-one
영어명: Proquinazid
분자식: C14H17IN2O2
분자량: 372.2

이름 및 동의어

Proquinazid189278-12-46-iodo-2-propoxy-3-propylquinazolin-4(3H)-one6-iodo-2-propoxy-3-propyl-4(3H)-quinazolinoneLIH67H4H0ZDTXSID1058008CHEBI:83555RefChem:176570DTXCID4031776606-168-7Proquinazid [ISO]UNII-LIH67H4H0Z

이름 더 보기

dpx-kq926Proquinazid SolutionProquinazid in AcetonitrileProquinazid 100 μg/ml AcetonitrileProquinazid 10 μg/mL in CyclohexaneProquinazid@100 μg/mL in AcetonitrileL16542000CY Proquinazid 10μg/mLin Cyclohexane4(3H)-Quinazolinone, 6-iodo-2-propoxy-3-propyl-

6-iodo-2-propoxy-3-propylquinazolin-4-one6-Iodo-2-propoxy-3-propyl-4(3H)-quinazolinone; Talius6-?Iodo-?2-?propoxy-?3-?propylquinazolin-?4(3H)?-?oneMFCD11616763PROQUINAZID [MI]SCHEMBL21925orb3210896MSK21137

데이터베이스 식별자

CAS: 189278-12-4
PubChem CID: 11057771
DTXSID: DTXSID1058008
ChEBI: CHEBI:83555
UNII: LIH67H4H0Z
EC Number: 606-168-7
Nikkaji: J2.417.039J

물성

구조 계산 물성

XLogP: 3.7
극성 표면적: 41.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 5
무거운 원자 수: 19
형식 전하: 0
복잡도: 359

실험 및 물리화학적 성질

Pesticides · 5건

Agrochemicals -> Pesticide active substances

Active substance -> EU Pesticides database: Approved

Environmental transformation -> Pesticides (parent, predecessor)

Fungicides

Pesticide (Proquinazid) -> USDA PDB

Endocrine DisruptorsPotential endocrine disrupting compound

Collision Cross Section169.35 Å² [M+H]+ [CCS Type: TW]

물리화학적 성질

저장 조건: -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
용해도: DMSO(약간 용해됨, 가열), 메탄올(약간 용해됨)
색상: 흰색에서 황백색까지
Henry's Law Constant: 3.3 · 3.3×101 mol/(m3Pa) at 25℃, Maniere et al. (2011)
주요 응용: 농업환경
InChI: 1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3
InChIKey: FLVBXVXXXMLMOX-UHFFFAOYSA-N
SMILES: CCCOC1=Nc2ccc(I)cc2C(=O)N1CCC
EPA: 4 · 4(3H)-Quinazolinone, 6-iodo-2-propoxy-3-propyl- (189278-12-4)

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H351: Suspected of causing cancer [Warning Carcinogenicity]

P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)

Warning

H351 (69.8%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory Information · 3건

Regulation (EC) No 396/2005 (amended)

Proquinazid is listed in the dataset of EPA Human Health Benchmarks for Pesticides under the Safe Drinking Water Act (40 eCFR 141)

2010/25/EU, Reg. (EU) 2017/2069, Reg. (EU) 2022/708, Reg. (EU) 2023/918, Reg. (EU) 2026/372 , Reg. (EU) No 540/2011

Hazard Classes and Categories · 3건

Carc. 2 (69.8%)

Carcinogenicity - category 2

Carc. 2

독성 정보

RAIS Toxicity Values · 4건

0.05

OPP

0.004

OPP

EPA Human Health Benchmarks for Pesticides · 6건

Proquinazid

0.05

300

Children

0.004

20

안전 데이터

wgk: 3
ridadr: UN 3077 9 / PGIII
risk_code: 50/53
hazard_code: N
safety_code: 60-61
Hazard Classifications: Aquatic Acute 1Aquatic Chronic 1Carc. 2
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

Use Classification · 2건

Fungicides

Environmental transformation -> Pesticides (parent, predecessor)

응용 분야

용도6-Iodo-2-propoxy-3-propylquinazolin-4(3H)-one is a fungicidal agent. Pesticide.

일반 설명Proquinazid belongs to the quinazolinone class of fungicides.

공급사17 곳

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]

Syntechem Co.,Ltd[email protected]

梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

上海艾梯西生物科技有限公司18721763493

추가 설명 · 1건

정의ChEBI: A member of the class of quinazolines that is quinazolin-4-one substituted at positions 2, 3 and 6 by propoxy, propyl and iodo groups respectively. A fungicide with the potential to control powdery mildew in a range of crops including cereals and grapes.

연결된 노트

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