피카클로포스

Pyraclofos

HCID 93460CAS 77458-01-6

기본 정보

표준 SMILES: CCCSP(=O)(OCC)Oc1cnn(-c2ccc(Cl)cc2)c1
InChIKey: QHGVXILFMXYDRS-UHFFFAOYSA-N
분자식: C14H18ClN2O3PS
평균 분자량: 360.8 g/mol
단동위원소 질량: 360.04642775

개요

Pyraclofos is an organochlorine insecticide, an organothiophosphate insecticide, a member of pyrazoles, an organosulfur compound, an organic thiophosphate and a member of monochlorobenzenes. It has a role as an agrochemical and an EC 3.1.1.7 (acetylcholinesterase) inhibitor.

이름 및 식별자

우선 이름: Pyraclofos
IUPAC: 1-(4-chlorophenyl)-4-[ethoxy(propylsulfanyl)phosphoryl]oxypyrazole
현지명: 피카클로포스
영어명: Pyraclofos
분자식: C14H18ClN2O3PS
분자량: 360.8

이름 및 동의어

PyraclofosBoltageVoltage89784-60-1M0W5LEC929O-[1-(4-chlorophenyl)-1H-pyrazol-4-yl] O-ethyl S-propyl phosphorothioatePhosphorothioic acid, O-(1-(4-chlorophenyl)-1H-pyrazol-4-yl) O-ethyl S-propyl esterO-(1-(4-Chlorophenyl)-1H-pyrazol-4-yl) O-ethyl S-propyl phosphorothioateDTXSID4058493CHEBI:38876Phosphorothioic acid, O-[1-(4-chlorophenyl)-1H-pyrazol-4-yl] O-ethyl S-propyl esterRefChem:870400

이름 더 보기

티오인산O-1-(4-클로로페닐)-4-피라조릴-O-에틸-S-프로필피카클로포스티오인산O-1-(4-클로로페닐)-4-피라조릴-O-에틸-S-프로필TIA 230SC 1069OMS3034VOLTAGE(R)BOLTAGE(R)STARLEX(R)pyrazolethion

DTXCID2032263OMS-3040O-(1-(4-chlorophenyl)-4-pyrazolyl) O-ethyl S-propyl phosphorothioate618-301-6623-723-977458-01-6Pyraclofos [ISO]1-(4-chlorophenyl)-4-[ethoxy(propylsulfanyl)phosphoryl]oxypyrazole

데이터베이스 식별자

CAS: 77458-01-6、89784-60-1
PubChem CID: 93460
DTXSID: DTXSID4058493
ChEBI: CHEBI:38876
UNII: M0W5LEC929
EC Number: 618-301-6、623-723-9
Nikkaji: J209.334K

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 78.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 8
무거운 원자 수: 22
형식 전하: 0
복잡도: 383

실험 및 물리화학적 성질

Pesticides · 3건

Acaricides

Active substance -> EU Pesticides database: Not approved

Pesticide (Pyraclofos) -> USDA PDB

LogP3.77

물리화학적 성질

녹는점: 25 °C · 25°C
끓는 점: 164 approximate · 164approximate 164℃(0.013hPa)
밀도: 1.27 · 1.27
증기압: 1.6 · 1.6×10-6 Pa (20 °C)
저장 조건: 0 · 0-6°C
수용성: 33 · 33
물리적 상태: 액체
Specific Gravity: 1.271 · 1.271 (28℃)
Henry's Law Constant: 2.3 · 2.3×104 mol/(m3Pa) at 25℃, Ebert et al. (2023)
EPA: 1 · Phosphorothioic acid, O-[1-(4-chlorophenyl)-1H-pyrazol- 4-yl] O-ethyl S-propyl ester(77458-01-6)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

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

Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

유해성 정보

Regulatory Information2002/2076

Hazard Classes and Categories · 5건

Acute Tox. 3 (100%)

Acute toxicity (Oral) - Category 3

Self-reactive substances and mixtures - Type G

안전 데이터

rtecs: TE8346000
ridadr: 3018
HS 번호: 29331990
risk_code: 22
hazard_code: Xi,Xn
포장분류: III
위험 등급: 6.1(b)

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationPesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics.

응용 분야

용도Pyraclofos is used to control Lepidoptera, Coleoptera, mites and nematodes in fruit, vegetables, ornamentals and forestry. It has also been used in a human health application to control filarial worms.

상·하류 제품 정보

상류 원료

공급사12 곳

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

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

上海毕楷科技有限公司18516304666

成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]

Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]

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