CAS 6609-64-9 2-Chloro-1,3,2-dioxaphospholane 2-oxide (HCID 81087)

기본 정보

CAS: 6609-64-9
표준 SMILES: O=P1(Cl)OCCO1
InChIKey: SBMUNILHNJLMBF-UHFFFAOYSA-N
분자식: C2H4ClO3P
평균 분자량: 142.48 g/mol
단동위원소 질량: 141.9586583

이름 및 식별자

우선 이름: 2-Chloro-1,3,2-dioxaphospholane 2-oxide
IUPAC: 2-chloro-1,3,2λ5-dioxaphospholane 2-oxide
영어명: 2-Chloro-1,3,2-dioxaphospholane-2-oxide
분자식: C2H4ClO3P
분자량: 142.48

이름 및 동의어

6609-64-92-Chloro-1,3,2-dioxaphospholane 2-oxide2-Chloro-2-oxo-1,3,2-dioxaphospholaneEINECS 229-560-6DTXSID70216292RefChem:468213DTXCID70138783229-560-62-Chloro-1,3,2-dioxaphospholane-2-oxideEthylene Chlorophosphate2-chloro-1,3,2lambda5-dioxaphospholane 2-oxideMFCD00043138

이름 더 보기

Ethylene cycl-chlorophosphate (2-chloro-2-oxo-1,3,2-dioxaphospholane)Ethylene chl2-chloro-1,3,2CYCLIC CHLOROPHOSPHATEEthylene chlorophosphate, tech. 90%Ethylene glycol chlorophosphate, 95%

Ethylene glycol chlorophosphate7EBS5ZK92N1,3,2-Dioxaphospholane, 2-chloro-, 2-oxideC2H4ClO3P2-Chloro-1,3,2-dioxaphospholane-2-oxide, tech.Ethylene cycl-chlorophosphate2-Chloro-1,3,2-dioxaphospholane-2-oxide (Technical Grade)2-chloro-1,3,2lambda5-dioxaphospholan-2-one

데이터베이스 식별자

CAS: 6609-64-9
PubChem CID: 81087
DTXSID: DTXSID70216292
UNII: 7EBS5ZK92N
EC Number: 229-560-6
Nikkaji: J185.646D、J641.418D

물성

구조 계산 물성

XLogP: 0
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 7
형식 전하: 0
복잡도: 104

실험 및 물리화학적 성질

SpringerMaterials PropertiesSchoenflies notation

물리화학적 성질

녹는점: 12 · 12-14 °C
끓는 점: 89 · 89-91 °C0.8 mm Hg(lit.)
밀도: 1.55 g/mL · 1.55 g/mL at 25 °C(lit.)
증기압: 1.06 hPa · 1.06hPa at 25℃
굴절률: 20 · n20/D 1.45(lit.)
인화점: 230 °F · >230 °F
저장 조건: -20 °C · -20°C
용해도: 클로로포름(수용성), 에틸아세테이트(약간 용해됨)
물리적 상태: 고체 또는 필름
색상: 흰색에서 황백색까지
수용성: 물 및 클로로포름과 혼합 가능.
BRN: 606582 · 606582
안정성: 수분에 매우 민감함
InChI: 1S/C2H4ClO3P/c3-7(4)5-1-2-6-7/h1-2H2
InChIKey: SBMUNILHNJLMBF-UHFFFAOYSA-N
SMILES: ClP1(=O)OCCO1
LogP: -0.485 at · -0.485 at 25℃ and pH7

안전 및 규제

GHS 분류

GHS Classification · 4건

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 44 reports by companies from 7 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory InformationStatus: No longer Valid Update: 19-04-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24132

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: 3
ridadr: UN 3265 8/PG 2
HS 번호: 29209090
risk_code: 14-34
hazard_code: C
safety_code: 26-36/37/39-45-8-25-27
포장분류: II
위험 등급: 8
F 고인화성물질: 10
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야

용도2-Chloro-1,3,2-dioxaphospholane-2-oxide is used in the synthesis of α-naphthylphosphorylcholine as a method to detect phospholipase C activity.

일반 설명2-Chloro-1,3,2-dioxaphospholane 2-oxide (COP) is a cyclic chlorophosphate reagent that can be prepared from 2-chloro-1,3,2-dioxaphospholane by reacting with molecular oxygen.