기본 정보
- CAS
677-43-0- 표준 SMILES
CN(C)P(=O)(Cl)Cl- InChIKey
YNHXBEVSSILHPI-UHFFFAOYSA-N- 분자식
- C2H6Cl2NOP
- 평균 분자량
- 161.95 g/mol
- 단동위원소 질량
- 160.9564058
개요
This is a chemical weapon, chemical weapon precursor, or chemical weapon impurity which is similar to ethyl phosphorodichloridate. See the chemical datasheet for ethyl phosphorodichloridate for more information.
이름 및 식별자
- 우선 이름
- N,N-Dimethylaminophosphoryl dichloride
- IUPAC
- N-dichlorophosphoryl-N-methylmethanamine
- 현지명
- N,N-다이메틸포스포라믹 다이클로라이드
- 영어명
- N,N-DIMETHYLPHOSPHORAMIDODICHLORIDATE
- 분자식
- C2H6Cl2NOP
- 분자량
- 161.95
이름 및 동의어
677-43-0Dimethylphosphoramidic dichlorideDichlorophosphoric dimethylamidePHOSPHORAMIDIC DICHLORIDE, DIMETHYL-(Dimethylamido)phosphoric dichlorideDimethylamidophosphoric acid dichlorideN,N-Dimethylaminophosphoryl dichlorideEINECS 211-641-2XG32RK7L5QN,N-Dimethyl phosphoramidic dichlorideNSC 203138BRN 0969956
이름 더 보기
N,N-다이메틸포스포라믹 다이클로라이드DMPADC(CH3)2NPOCl2Dimethylamidophosphoric Dichlordimethyl-phosphoramidicdichloriddimethylphosphoramidicdichloridedichlorophosphoryl(dimethyl)amine
AI3-19436NSC-2031384-04-00-00281 (Beilstein Handbook Reference)PHOSPHORAMIDIC DICHLORIDE, N,N-DIMETHYL-RefChem:822576DIMETHYLPHOSPHORAMIDODICHLORIDATE211-641-2N,N-Dimethylphosphoramidodichloridate
데이터베이스 식별자
- CAS
677-43-0- PubChem CID
- 12673
- DTXSID
DTXSID4074801- UNII
- XG32RK7L5Q
- EC Number
- 211-641-2
- Nikkaji
- J50.370C
물성
구조 계산 물성
- XLogP
- 1.2
- 극성 표면적
- 20.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 7
- 형식 전하
- 0
- 복잡도
- 97.9
실험 및 물리화학적 성질
SpringerMaterials PropertiesSchoenflies notation
Physical DescriptionThis is a chemical weapon, chemical weapon precursor, or chemical weapon impurity which is similar to ethyl phosphorodichloridate. See the chemical datasheet for ethyl phosphorodichloridate for more information.
물리화학적 성질
- 끓는 점
- 77 · 77-79 °C/11 mmHg (lit.)
- 밀도
- 1.362 g/mL · 1.362 g/mL at 20 °C (lit.)
- 굴절률
- 20 · n20/D 1.464
- 인화점
- 89 · 89-90°C/20mm
- 저장 조건
- 2 · 2-8°C
- 용해도
- 디메톡시에탄과 혼합 가능.
- 산도 계수 (pKa)
- -6.6 · -6.60±0.70(Predicted)
- 물리적 상태
- 기름진 또는 반고체
- 색상
- 무색~황백색
- BRN
- 969956 · 969956
- 안정성
- 흡습성, 수분 민감성
- InChI
- InChI=1S/C2H6Cl2NOP/c1-5(2)7(3,4)6/h1-2H3
- InChIKey
- YNHXBEVSSILHPI-UHFFFAOYSA-N
- SMILES
- P(N(C)C)(Cl)(Cl)=O
- EPA
- N,N-Dimethyl phosphoramidic dichloride (677-43-0)
화학적 성질
Light yellow liquid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, 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.
유해성 정보
Reactive GroupAmides and Imides
Reactivity AlertsWater-Reactive
Reactivity ProfileIn contact with water, this chemical is expected to generate corrosive hydrochloric acid and acidic fumes.
Air and Water ReactionsThis compound is expected to form corrosive hydrochloric acid on contact with water.
Hazard Classes and CategoriesSkin Corr. 1B (100%)
DHS Chemicals of Interest (COI)
N,N-Dimethylphosphoramidic dichloride
30.00
2.2
Chemical Weapons/Chemical Weapons Precursors chemical material that, if stolen or diverted, can be converted into weapons using simple chemistry, equipment, or techniques.
규제 정보
DHS Chemicals of Interest (COI)
N,N-Dimethylphosphoramidic dichloride
30.00
2.2
Chemical Weapons/Chemical Weapons Precursors chemical material that, if stolen or diverted, can be converted into weapons using simple chemistry, equipment, or techniques.
안전 데이터
- wgk
- 3
- rtecs
- TB4025000
- ridadr
- UN 3265 8/PG 3
- risk_code
- 34-37
- hazard_code
- C
- safety_code
- 26-36/37/39
- 포장분류
- II
- 위험 등급
- 8
- F 고인화성물질
- 1-3-10
- Hazard Classifications
- Skin Corr. 1B
- 스토리지 클래스
- 8A - Combustible corrosive hazardous materials
화학 및 산업
응용 분야
용도N,N-Dimethylphosphoramidodichloridate is used in the synthesis of phosphoramidates as well as (RS)-ethyl N,N-dimethylphosphoramidocyanidate (Nerve agent GA) which is used as a chemical weapon. It forms active intermediates, which react with alcohols in situ to give esters. It is also used to convert primary alcohols to alkyl chlorides. Furthe, it serves as an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff. In addition to this, it reacts with 1,2 diols to prepare cyclic phosphoric amides followed by alkenes after reduction.
제조 방법
N,N-DIMETHYLPHOSPHORAMIDODICHLORIDATE is obtained by treatment of Phosphorus Oxychloride with dimethylamine.
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