Methyl diethylphosphonoacetate (HCID 66113)

이름 및 식별자

우선 이름: Methyl diethylphosphonoacetate
IUPAC: methyl 2-diethoxyphosphorylacetate
영어명: Methyl diethylphosphonoacetate
분자식: C7H15O5P
분자량: 210.16

이름 및 동의어

Methyl diethylphosphonoacetate1067-74-9Acetic acid, (diethoxyphosphinyl)-, methyl esterEINECS 213-938-2methyl (diethylphosphono)acetateNSC 147757DTXSID50147732RefChem:817722DTXCID6070223Diethyl methoxycarbonylmethanephosphonate213-938-2methyl 2-(diethoxyphosphoryl)acetate

이름 더 보기

POMEdiethyl methoxycarbonylmethyl phosphonateAPAZ-027LABOTEST-BB LT00452673Mirogabalin Impurity 59Methyl 2-(diethoxyphosphoryl)

methyl 2-diethoxyphosphorylacetateC7H15O5PMethyl (diethoxyphosphoryl)acetateMFCD00009081DiethylmethylphosphonoacetateDiethylphosphonoacetic Acid Methyl Ester(Methoxycarbonylmethyl) diethoxyphosphine oxideMethyl P,P-diethylphosphonoacetate

데이터베이스 식별자

CAS: 1067-74-9
PubChem CID: 66113
DTXSID: DTXSID50147732
EC Number: 213-938-2
Nikkaji: J21.052H

물성

구조 계산 물성

XLogP: 0.1
극성 표면적: 61.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 7
무거운 원자 수: 13
형식 전하: 0
복잡도: 193

물리화학적 성질

끓는 점: 127 · 127-131 °C9 mm Hg(lit.)
밀도: 1.145 g/mL · 1.145 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.433(lit.)
인화점: 230 °F · >230 °F
저장 조건: Sealed in dry,Room Temperature
용해도: 테트라히드로푸란과 혼합 가능.
물리적 상태: 액체
색상: 무색투명~엷은 노란색
BRN: 1782397 · 1782397
InChI: InChI=1S/C7H15O5P/c1-4-11-13(9,12-5-2)6-7(8)10-3/h4-6H2,1-3H3
InChIKey: CTSAXXHOGZNKJR-UHFFFAOYSA-N
SMILES: C(OC)(=O)CP(OCC)(OCC)=O
NIST: Acetic acid, phosphono-, p,p-diethyl c-methyl ester(1067-74-9)

화학적 성질

Clear colorless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (97.9%): 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 48 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationDiethyl methoxycarbonylmethanephosphonate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (97.9%)

안전 데이터

wgk: 3
HS 번호: 29310095
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
F 고인화성물질: 10
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야 · 1건

용도Methyl diethylphosphonoacetate is used as a reagent in the preparation of allylic fluorides compounds and in regioselective Diels-Alder reactions. It also serves as a reactant in the preparation of substituted thiophenes and furans, which finds application in type 2 diabetes treatment. Further, it acts as a precursor in the synthesis of pyridone alkaloids and immunosuppressive cyclopentanediol derivatives. In addition to this, it is utilized in the modification of botulinum neurotoxin serotype A protease inhibitors.

상·하류 제품 정보

상류 원료

하류 제품

메틸트랜스-2-헥세노에이트,98 Methyl (2E)-3-(2-bromopyridin-3-yl)prop-2-enoate

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

南通润丰石油化工有限公司66017690 19952660367 · [email protected]

연결된 노트

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Methyl diethylphosphonoacetate

기본 정보