디클로로아세트산메틸에스테르

Methyl dichloroacetate

HCID 8315CAS 116-54-1

기본 정보

표준 SMILES
COC(=O)C(Cl)Cl
InChIKey
HKMLRUAPIDAGIE-UHFFFAOYSA-N
분자식
C3H4Cl2O2
평균 분자량
142.97 g/mol
단동위원소 질량
141.95883473

개요

Methyl dichloroacetate appears as a colorless liquid with an ethereal odor. Combustible. Flash point 176 °F. Corrosive to metals and tissue. Used to make other chemicals.

이름 및 식별자

우선 이름
Methyl dichloroacetate
IUPAC
methyl 2,2-dichloroacetate
현지명
디클로로아세트산메틸에스테르
영어명
Dichloroacetic acid methyl ester
분자식
C3H4Cl2O2
분자량
142.97

이름 및 동의어

METHYL DICHLOROACETATEDichloroacetic acid methyl esterAcetic acid, 2,2-dichloro-, methyl esterCCRIS 7740NSC 2882EINECS 204-146-8HG7W497BZUUN2299AI3-18187NSC-2882DTXSID2059433UN 2299
이름 더 보기
디클로로아세트산메틸에스테르메틸다이클로로아세트산메틸디클로로아세트산메틸다이클로로아세트산메틸 다이클로로아세테이트TwoMethyl chloroacetatemethyldichloroethanoatemethyl2,2-dichloroacetateDichloroacetic acid methylMethyl Dichloroacetate >Methyl dichloroacetate,purumMETHYL DICHLOROACETATE, 99+%dichloro-aceticacimethylester
ACETIC ACID,DICHLORO,METHYL ESTERDicloroacetato de metiloDichloracetate de methyleRefChem:157843Methyl 2,2dichloroacetateDTXCID6033372Acetic acid, dichloro, methyl esterAcetic acid, 2,2dichloro, methyl ester

데이터베이스 식별자

CAS
116-54-1
PubChem CID
8315
DTXSID
DTXSID2059433
UNII
HG7W497BZU
EC Number
204-146-8
Nikkaji
J38.900E

물성

구조 계산 물성

XLogP
1.5
극성 표면적
26.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
2
무거운 원자 수
7

실험 및 물리화학적 성질

Chemical Classes · 2건

Other Classes -> Halogenated Esters

Flammable agents - 2nd degree

SpringerMaterials PropertiesSchoenflies notation
Density1.3774 at 68 °F (USCG, 1999) - Denser than water; will sink
Flash Point176 °F (USCG, 1999)
Boiling Point289 °F at 760 mmHg (USCG, 1999)
Melting Point-62 °F (USCG, 1999)

물리화학적 성질

녹는점
-52 °C · -52 °C (lit.)
끓는 점
143 °C · 143 °C (lit.)
밀도
1.381 g/mL · 1.381 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.442(lit.)
인화점
176 °F · 176 °F
저장 조건
room temp

화학적 성질

clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P317, 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 61 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

H227: Combustible liquid [Warning Flammable liquids]

유해성 정보

Regulatory Information · 3건

Status: Active Update: 31-05-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/17723

Methyl dichloroacetate: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelPoison
Fire Hazards · 2건

Special Hazards of Combustion Products: Produces toxic fumes of phosgene and HCl. (USCG, 1999)

· Combustible material: may burn but does not ignite readily.

Health Hazards · 2건

Extremely destructive to the eyes, nose, throat, and upper respiratory tract. May be fatal as a result of spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis, and pulmonary edema. Symptoms of exposure include burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea, and vomiting. (USCG, 1999)

· TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.

Hazards Summary · 1건

Reacts with water producing dichloroacetic acid; Corrosive to tissue; [CAMEO] Hydrolyzed evolving corrosive products; Causes severe skin irritation and serious eye injury; Brief contact can causes second- and third-degree skin burns; Inhalation may cause pulmonary edema and chemical pneumonitis; [CHRIS] Causes focal lung fibrosis and GI changes in inhalation lethal-concentration studies of rats; [RTECS] Reacts with water; Causes burns (especially if skin is wet or moist); Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Acros Organics MSDS]

DOT ID and Guide2299 156

안전 및 보호

Fire FightingExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Accidental Release Measures · 2건

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2건

Call a physician.

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Isolation and Evacuation · 2건

Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:

Immediate precautionary measure

독성 정보

Adverse EffectsDermatotoxin - Skin burns.
Toxicity DataLCLo (rat) = 2,000 ppm/30min

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
AG6625000
ridadr
UN 2299
HS 번호
29154000
risk_code
20-36/37/38-40-38-11

화학 및 산업

용도 및 제조

UsesUsed to make other chemicals; [CAMEO]
General Manufacturing InformationAcetic acid, 2,2-dichloro-, methyl ester: ACTIVE

응용 분야

용도Dichloroacetic Acid Methyl Ester is used in the preparation of telechelics and block copolymers through living radical polymerization.

일반 설명A colorless liquid with an ethereal odor. Combustible. Flash point 176°F. Corrosive to metals and tissue. Used to make other chemicals.

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]
上海毕合生物化学技术有限公司13816464724 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

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