Pivaloylchlorid

Pivaloyl chloride

HCID 62493CAS 3282-30-2

Grundinformationen

Standard-SMILES
CC(C)(C)C(=O)Cl
InChIKey
JVSFQJZRHXAUGT-UHFFFAOYSA-N
Summenformel
C5H9ClO
Durchschnittliche Molmasse
120,58 g/mol
Monoisotopische Masse
120,03419259

Überblick

Trimethylacetyl chloride appears as colorless fuming liquid with a pungent odor. Very toxic by inhalation, ingestion or skin absorption. Fumes irritate the eyes and mucous membranes. Corrosive to most metals and tissue.

Namen und Bezeichner

Bevorzugter Name
Pivaloyl chloride
IUPAC
2,2-dimethylpropanoyl chloride
Lokaler Name
Pivaloylchlorid
Englischer Name
Pivaloyl chloride
Summenformel
C5H9ClO
Molmasse
120.58

Namen und Synonyme

Pivaloyl chloride3282-30-2Trimethylacetyl chloride2,2-DIMETHYLPROPANOYL CHLORIDEPropanoyl chloride, 2,2-dimethyl-Pivalyl chloride2,2-Dimethylpropionyl chloridePivalolyl chloridePivalic acid chlorideNeopentanoyl chlorideDTXSID40275292,2-dimethylpropionic acid chloride
Weitere Namen anzeigen
PivClPVCLpivaloyl2,2-Dimethyl-propanoyl chloride
JQ82J0O21TDTXCID907529TERT-BUTYL CHLORO KETONE1,1-DIMETHYLETHANECARBONYL CHLORIDERefChem:174625221-921-6pivalic chloride2,2-dimethyl-propionyl chloride

Datenbank-Bezeichner

CAS
3282-30-2
PubChem CID
62493
DTXSID
DTXSID4027529
ChEMBL
CHEMBL3183814
UNII
JQ82J0O21T
EC Number
221-921-6
Nikkaji
J33.810I

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,2
Polarare Oberfläche (TPSA)
17,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
7

Experimentelle und physikochemische Eigenschaften

Chemical Classes · 2 Einträge

Toxic Gases & Vapors -> Acid Halides

Flammable agents - 3rd degree

SpringerMaterials PropertiesChemical shift
Density1.003 @ 20°C
Flash Point48 °F
Boiling Point · 2 Einträge

105-106 °F

107 °C @760 [mm Hg]

Vapor Pressure1.18 [mmHg]

Physikochemische Eigenschaften

Schmelzpunkt
-56 °C · -56 °C
Siedepunkt
105 · 105-106 °C(lit.)
Dichte
0.98 g/mL · 0.980 g/mL at 20 °C
Dampfdichte
1 · >1 (vs air)
Dampfdruck
36 mm · 36 mm Hg ( 20 °C)
Brechungsindex
20 · n20/D 1.412(lit.)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 17.8% (52 of 292) of reports.

Danger

H225 (81.8%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P234, P240, P241, P242, P243, P260, P264, P264+P265, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P363, P370+P378, P390, P403+P233, P403+P235, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 292 reports by companies from 19 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

Gefahrenhinweise

Hazards IdentificationToxic/poison by inhalation (TIH/PIH)
Regulatory Information · 5 Einträge

Chemical: Propanoyl chloride, 2,2-dimethyl-

Propanoyl chloride, 2,2-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanoyl chloride, 2,2-dimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 15-09-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/13938

Pivaloyl chloride: HSNO Approval: HSR004648 Approved with controls

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.)

Other Safety InformationIMAP assessments - Propanoyl chloride, 2,2-dimethyl-: Human health tier I assessment
DOT LabelPoison Inhalation Hazard Corrosive Flammable Liquid
Fire Hazards · 2 Einträge

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Health Hazards · 2 Einträge

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

· TOXIC; may be fatal if inhaled, ingested or absorbed through skin.

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 131 [Flammable Liquids - Toxic]:
Accidental Release Measures · 2 Einträge

· 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 · 2 Einträge

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

General First Aid:

Exposure Control and Personal Protection · 2 Einträge

· Wear positive pressure self-contained breathing apparatus (SCBA).

TIH (Toxic Inhalation Hazard) - Term used to describe gases and volatile liquids that are toxic when inhaled. Some are TIH materials themselves, e.g., chlorine, and some release TIH gases when spilled in water, e.g., chlorosilanes. [ERG 2016].

Nonfire Spill ResponseExcerpt from ERG Guide 131 [Flammable Liquids - Toxic]:
Isolation and Evacuation · 4 Einträge

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

Immediate precautionary measure

Small spill:

Small spill:

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.

Sicherheitsdaten

F
9-19
wgk
1
tsca
TSCA listed
ridadr
UN 2438
hs_code
29159080
risk_code
11-14-22-26-34-23

Chemie und Industrie

Verwendung und Herstellung

UsesUsed as a chemical intermediate; [CHEMINFO MSDS]
U.S. Production2023: 500,000 - <1,000,000 lb
Industry UsesIntermediate
General Manufacturing Information · 2 Einträge

All Other Basic Organic Chemical Manufacturing

Propanoyl chloride, 2,2-dimethyl-: ACTIVE

Anwendungen

VerwendenWidely used N-acylating agent for amines,1 Schiff bases,2 and pyrrolidinones3 as well as O-acylating agent for alcohols,4 lactones,5 and saccharides.6

Anbieter50 Anbieter

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上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
河北立业化学制品有限公司0310-6697998 13930001710 · [email protected]

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