2,2,2-트리클로로에틸클로로포메이트

2,2,2-Trichloroethyl chloroformate

HCID 87063CAS 17341-93-4
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C(Cl)OCC(Cl)(Cl)Cl
InChIKey
LJCZNYWLQZZIOS-UHFFFAOYSA-N
분자식
C3H2Cl4O2
평균 분자량
211.9 g/mol
단동위원소 질량
209.88089002

개요

reagent for gas chromatographic analysis of pethidine; structure

이름 및 식별자

우선 이름
2,2,2-Trichloroethyl chloroformate
IUPAC
2,2,2-trichloroethyl carbonochloridate
현지명
2,2,2-트리클로로에틸클로로포메이트
영어명
2,2,2-Trichloroethyl chloroformate
분자식
C3H2Cl4O2
분자량
211.86

이름 및 동의어

2,2,2-Trichloroethyl chloroformate17341-93-4Trichloroethyl chloroformateCarbonochloridic acid, 2,2,2-trichloroethyl ester2,2,2-Trichloroethoxycarbonyl chloride99UY6LZN4RNSC-152038DTXSID3066188RefChem:900652DTXCID5035539241-363-72,2,2-trichloroethyl carbonochloridate
이름 더 보기
2,2,2-트리클로로에틸클로로포메이트2,2,2-Trichloroethyltrichloroethylchloroformate(Trichloroethoxy)chloroformate2,2,2 TRI CHLOROETHYL CHLOROFORMAT2,2,2-trichloroethyl chlorocarbonate
2,2,2-trichloroethylchloroformateTroc-ClMFCD00000810Chloroformic acid 2,2,2-trichloroethyl esterFormic acid, chloro-, 2,2,2-trichloroethyl ester2,2,2-trichloroethylchloranuidylformatebeta,beta,beta-trichloroethyl chloroformatetrichloroethoxycarbonyl chloride

데이터베이스 식별자

CAS
17341-93-4
PubChem CID
87063
DTXSID
DTXSID3066188
UNII
99UY6LZN4R
EC Number
241-363-7
Nikkaji
J42.326B

물성

구조 계산 물성

XLogP
3
극성 표면적
26.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
2
무거운 원자 수
9

실험 및 물리화학적 성질

Chemical ClassesToxic Gases & Vapors -> Acid Halides
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Vapor Pressure3.1 [mmHg]
Physical DescriptionLight yellow liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점
1 °C · 1°C
끓는 점
171 · 171-172 °C (lit.)
밀도
1.539 g/mL · 1.539 g/mL at 25 °C (lit.)
증기압
0.06 psi · 0.06 psi ( 20 °C)
굴절률
20 · n20/D 1.471(lit.)
인화점
100 °C · >100°C

화학적 성질

Clear light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (17%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P320, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: Carbonochloridic acid, 2,2,2-trichloroethyl ester

Carbonochloridic acid, 2,2,2-trichloroethyl ester: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazards SummaryCauses burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract; Toxic by inhalation; [Sigma-Aldrich MSDS] See CHLOROFORMATES.
Hazard Classes and CategoriesAcute Tox. 4 (17%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk
3
tsca
TSCA listed
ridadr
UN 3277 6.1/PG 2
HS 번호
29159000
risk_code
23-34-36
hazard_code
T

화학 및 산업

용도 및 제조

UsesReagent for gas chromatographic analysis of pethidine. [ChemIDplus]
General Manufacturing InformationCarbonochloridic acid, 2,2,2-trichloroethyl ester: ACTIVE
응용 분야 · 1건

용도2,2,2-Trichloroethyl chloroformate is used as a protecting reagent for aliphatic and aromatic hydroxyl and amino groups. It is used as derivatizing reagent in gas chromatographic/mass spectrometric determination of a large range of amphetamine-related drugs and ephedrines in plasma, urine and hair samples, during N-demethylation of dextromethorphan. It was used as starting reagent during the synthesis of 6-Nor-9,10-dihydrolysergic acid methyl ester.

상·하류 제품 정보

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]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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