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o,o-diethyl thiophosphate potassium salt

HCID 23664334
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
5871-17-0
표준 SMILES
CCOP([O-])(=S)OCC.[K+]
InChIKey
OVJCAYMARFNMQB-UHFFFAOYSA-M
분자식
C4H10KO3PS
평균 분자량
208.26 g/mol
단동위원소 질량
207.97253349

개요

O,O-Diethyl thiophosphate (potassium salt) is an organic thiophosphate.

이름 및 식별자

우선 이름
o,o-diethyl thiophosphate potassium salt
IUPAC
potassium diethoxy-oxido-sulfanylidene-λ5-phosphane
영어명
O,O-Diethyl thiophosphate, potassium salt
분자식
C4H10KO3PS
분자량
208.26

이름 및 동의어

O,O-Diethyl thiophosphate potassium saltPotassium O,O-diethylthiophosphateRefChem:855035627-567-25871-17-0potassium O,O-diethyl phosphorothioatePotassium diethyl thiophosphateMFCD00674011Phosphorothioic acid, O,O-diethyl ester, potassium saltVT22HR1IATpotassium;diethoxy-oxido-sulfanylidene-lambda5-phosphaneO,O-Diethyl thiophosphate
이름 더 보기
diethylthiophosphatediethylthiodiethylthiophosphoric acidPOTASSIUM DIETHYL THIOPHOSPHATE)"O,O-Diethyl hydrogen thiophosphate"Potassium di-O-ethyl phosphorothioateO,O-Diethyl thiophosphate (potassium)
Phosphorothioic acid, O,O-diethyl ester, potassium salt (1:1)UNII-VT22HR1IATbmse000653C4H10KO3PSpotassium diethylthiophosphateO,O-DIETHYL PHOSPHOROTHIOATE POTASSIUM SALTSCHEMBL844972SCHEMBL844973

데이터베이스 식별자

CAS
5871-17-0
PubChem CID
23664334
DTXSID
DTXSID4052718
ChEBI
CHEBI:195172
UNII
VT22HR1IAT
EC Number
627-567-2

물성

구조 계산 물성

극성 표면적
73.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
10
형식 전하
0
복잡도
111

물리화학적 성질

녹는점
180 · 180-186 °C(lit.)
인화점
9 ℃ · 9℃
저장 조건
-20 °C · -20°C
용해도
메탄올(약간 용해됨), 물(약간 용해됨)
물리적 상태
고체
색상
흰색에서 황백색까지
안정성
흡습성
InChI
1S/C4H11O3PS.K/c1-3-6-8(5,9)7-4-2;/h3-4H2,1-2H3,(H,5,9);/q;+1/p-1
InChIKey
OVJCAYMARFNMQB-UHFFFAOYSA-M
SMILES
[K+].CCOP([O-])(=S)OCC

안전 및 규제

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

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, 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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationHazard Traits - Developmental Toxicity; Neurotoxicity
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

독성 정보

Toxicity Summary · 1건

Diethylthiophosphate (DETP) induces DNA damage only in the hepatic cell lines, and this effect could be related to a secondary non-diffusible metabolite generated by the activity of P450 enzymes since P450 enzyme inhibitors also inhibited the induction of DNA damage in hepatic cells. This organophosphorous (OP) metabolite has shown some toxicity in human peripheral blood mononucleated cells (PBMC). DETP is a cytotoxic compound in human PBMC. A relationship between urinary levels of DETP and the number of sperm susceptible to chromatin alteration has been reported among rural agricultural workers. In addition, a correlation between the frequency of aneuploidy in sperm and the levels of DETP in urine was identified in a rural population exposed to OP pesticides, indicating that the potential for genotoxicity following OP exposure may depend on the type and quantity of specific metabolites produced, such as DETP. (A15411)

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

안전 데이터

wgk
3
ridadr
UN1230 - class 3 - PG 2 - Methanol, solution
risk_code
36/37/38-39/23/24/25-23/24/25-11
hazard_code
Xi,T,F
safety_code
26-36-45-36/37-16-7
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스
11 - Combustible Solids

화학 및 산업

약리 정보

Metabolism/Metabolites · 1건

Metabolism of organophosphates occurs principally by oxidation, by hydrolysis via esterases and by reaction with glutathione. Demethylation and glucuronidation may also occur. Oxidation of organophosphorus pesticides may result in moderately toxic products. In general, phosphorothioates are not directly toxic but require oxidative metabolism to the proximal toxin. The glutathione transferase reactions produce products that are, in most cases, of low toxicity. Paraoxonase (PON1) is a key enzyme in the metabolism of organophosphates. PON1 can inactivate some organophosphates through hydrolysis. PON1 hydrolyzes the active metabolites in several organophosphates insecticides as well as, nerve agents such as soman, sarin, and VX. The presence of PON1 polymorphisms causes there to be different enzyme levels and catalytic efficiency of this esterase, which in turn suggests that different individuals may be more susceptible to the toxic effect of organophosphate exposure.

용도 및 제조

UsesThis is a natural compound that is used as a pesticide.

공급사41 곳

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海药诚医药科技合伙企业(有限合伙)400-6181121 18616381138 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海稳同科技有限公司02151600108 13062666369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
郑州今斯孚化学有限公司0371-56635027 13838252817 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [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]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
上海谱振生物科技有限公司4001650900 13817534909 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海珈得尔化学技术有限公司13564435016 13564435016 · [email protected]
上海西陇生化科技有限公司021-52907766-8042
上海源叶生物科技有限公司18916372613 · [email protected]
安泰精细化工技术有限公司18503026267 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
上海泰坦科技股份有限公司13023226327 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
Aladdin Scientific[email protected]
常州新星联生物科技有限公司+86-0519-85551759 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
亚索试剂400-873-6778 18660992876 · [email protected]

관련 반응

5건
반응 기록 만들기
HRID 1080617 반응식
HRID 1080617생성물로uspto-grants-1996_12
HRID 1734979 반응식
HRID 1734979생성물로uspto-grants-1996_07
HRID 1734984 반응식
HRID 1734984생성물로uspto-grants-1996_07
HRID 1734989 반응식
HRID 1734989생성물로uspto-grants-1996_07
HRID 2210756 반응식
HRID 2210756생성물로uspto-grants-1995_10

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