Diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonate

HCID 2773719

기본 정보

CAS
124931-12-0
표준 SMILES
CCOP(=O)(CC(=O)N(C)OC)OCC
InChIKey
WYLRYBDGIILFIR-UHFFFAOYSA-N
분자식
C8H18NO5P
평균 분자량
239.21 g/mol
단동위원소 질량
239.09225931

이름 및 식별자

우선 이름
Diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonate
IUPAC
2-diethoxyphosphoryl-N-methoxy-N-methylacetamide
영어명
DIETHYL (N-METHOXY-N-METHYLCARBAMOYLMETHYL)PHOSPHONATE
분자식
C8H18NO5P
분자량
239.21

이름 및 동의어

Diethyl (N-methoxy-N-methylcarbamoylmethyl)phosphonateRefChem:587034626-937-0124931-12-0Diethyl (2-(methoxy(methyl)amino)-2-oxoethyl)phosphonate2-diethoxyphosphoryl-N-methoxy-N-methylacetamideMFCD00134233diethyl {[methoxy(methyl)carbamoyl]methyl}phosphonateDiethyl(N-methoxy-N-methylcarbamoylmethyl)phosphonateDTXSID703786672-diethoxyphosphoryl-N-methoxy-N-methyl-acetamideSBB057815
이름 더 보기
Diethyl (2-(methoxy(methyl)N-Methoxy-N-methyl-diethylphosphoacetamideDIETHYL N-METHOXY-N-METHYLPHOSPHONOACETAMIDEN-Methoxy-N-methyl-2-(diethyl phosphono)acetamideDiethylphosphonoacetic acid N-methyl-N-methoxyamidediethyl (N-ethoxy-N-methylcarbamoylmethyl)phosphonate
N-methoxy-N-methyl diethylphosphonoacetamideD3708N-methoxy-N-methyl diethylphosphonoacetarnide2-(diethoxycarbonyl)-N-methoxy-N-methylacetamidediethyl {2-[methoxy(methyl)amino]-2-oxoethyl}phosphonateDiethyl [2-[Methoxy(methyl)amino]-2-oxoethyl]phosphonatediethyl (n-methoxy-n-methylcarbamoyl-methyl)phosphonateN-Methoxy-N-methyl-phosphonoacetamide diethyl ester

데이터베이스 식별자

CAS
124931-12-0
PubChem CID
2773719
DTXSID
DTXSID70378667
EC Number
626-937-0
Nikkaji
J860.320K

물성

구조 계산 물성

XLogP
-0.2
극성 표면적
65.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
7
무거운 원자 수
15

물리화학적 성질

끓는 점
90 °C17 · 90 °C17 mm Hg(lit.)
밀도
1.163 g/mL · 1.163 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.455(lit.)
인화점
230 °F · >230 °F
저장 조건
Store at room temperature
물리적 상태
투명한 액체

안전 및 규제

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 42 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk
3
HS 번호
29319000
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3

화학 및 산업

응용 분야 · 1건

용도Reactant for:Preparation of ring-expanded bryostatin analogs as antitumor agentsAsymmertic synthesis of pinnatoxins A and G via diastereoselective Ireland-Claisen rearrangement, ring closing metathesis, and cyclizationRh2(II)-catalyzed nitro-group migration reactionsStereoselective synthesis of cyclohexanones via phase transfer catalyzed double addition reactionsStereoselective synthesis of (+)-polyrhacitide A via aldol reaction, Horner-Wardsworth-Emmons reaction, Evans acetal intramolecular oxa-Michael reaction and diastereoselective syn reduction reaction as the key stepsPreparation of substituted furans via olefin cross-metathesis

공급사70 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

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