Cyclopropylmethanol

Cyclopropanemethanol

HCID 75644CAS 2516-33-8
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
OCC1CC1
InChIKey
GUDMZGLFZNLYEY-UHFFFAOYSA-N
Summenformel
C4H8O
Durchschnittliche Molmasse
72,11 g/mol
Monoisotopische Masse
72,05751488

Überblick

potential anti-amoebic agent; inhibits alcohol dehydrogenase 2 from Entamoeba histolytica

Namen und Bezeichner

Bevorzugter Name
Cyclopropanemethanol
IUPAC
cyclopropylmethanol
Lokaler Name
Cyclopropylmethanol
Englischer Name
Cyclopropyl carbinol
Summenformel
C4H8O
Molmasse
72.11

Namen und Synonyme

CyclopropylmethanolCyclopropanemethanol2516-33-8Cyclopropyl carbinolCyclopropylcarbinolCyclopropylmethyl alcoholCyclopropanemethyl alcoholCyclopropylcarbinyl alcoholNSC-85925AQJ99GBE9FDTXSID2051922RefChem:129955
Weitere Namen anzeigen
CPMOCP-CARBINOLCPC-OLCyclopropylmethaneRARECHEM AK ML 0580Cyelopropyl carbinol
DTXCID7030484219-735-5(Hydroxymethyl)cyclopropaneHydroxymethylcyclopropaneMFCD00001309cyclopropylmethan-1-olCyclopropyl-MethanolEINECS 219-735-5

Datenbank-Bezeichner

CAS
2516-33-8
PubChem CID
75644
DTXSID
DTXSID2051922
UNII
AQJ99GBE9F
EC Number
219-735-5
Nikkaji
J175I

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0,3
Polarare Oberfläche (TPSA)
20,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
5

Experimentelle und physikochemische Eigenschaften

PolymersOther Classes -> Alcohols and Polyols, Other
SpringerMaterials PropertiesAtomic environment
Physical Description · 2 Einträge

Liquid

Clear light yellow liquid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
-60 °C · -60 °C
Siedepunkt
123 · 123-124 °C738 mm Hg(lit.)
Dichte
0.89 g/mL · 0.89 g/mL at 25 °C(lit.)
Brechungsindex
20 · n20/D 1.431(lit.)
Flammpunkt
95 °F · 95 °F
storage temp.
Flammables area

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H226 (99.2%): Flammable liquid and vapor [Warning Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P318, P319, P321, P330, P337+P317, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 120 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Cyclopropanemethanol

Cyclopropanemethanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclopropanemethanol 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: 17-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/23682

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

Hazards Summary · 1 Eintrag

Potentially neurotoxic effects observed in oral lethal-dose study of rats; Corrosive to rabbit skin; Histopathological changes of the heart (myocarditis with myocardial fiber necrosis) observed in 4-week inhalation study of rats at all tested concentrations (0.003 mg/L the lowest tested concentration); [EPA - TSCATS] A strong eye irritant; Harmful by ingestion; [Sigma-Aldrich MSDS] See Cyclohexanol.

Hazard Classes and CategoriesFlam. Liq. 3 (99.2%)

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.
Toxicity DataLC50 (rat) = 3,300 mg/m3/6hr

Sicherheitsdaten

wgk
1
tsca
TSCA listed
ridadr
UN 1987 3/PG 3
hs_code
29061990
RTECS-Nr.
GZ2212250
risk_code
10-22-36-34

Chemie und Industrie

Verwendung und Herstellung

Uses · 2 Einträge

Used as an intermediate for pharmaceuticals and other chemicals; [EPA - TSCATS]

Last manufactured by the Eastman Chemical Company in 1998; [EPA - TSCATS]

U.S. Production2023: <50,000 lb
Industry UsesIntermediate
General Manufacturing Information · 2 Einträge

Pharmaceutical and Medicine Manufacturing

Cyclopropanemethanol: ACTIVE

Anwendungen

VerwendenCyclopropylmethanol used to increase selectivity of pyridyl-cinnoline phosphodiesterase 10A, inhibitors against phosphodiesterase 3 (PDE3). Also used in the synthesis of benzodiazapin-2-ones

Darstellung · 1 Eintrag

synthetischeThe preparation of Cyclopropyl carbinol is as follows:A 1L three-necked flask was charged with 100 g (1mol) of methyl cyclopropanoate. 57g (1.5mol) of sodium borohydride, 500 mL of methanol, and then cooled to 2°C, 66.67g (0.5mol) of aluminum trichloride was added in batches and reacted overnight. The reaction was quenched by the addition of a saturated aqueous solution of ammonium chloride, filtered, and the filtrate was concentrated and evaporated. The product was collected in a yield of 53.49g, a yield of 74.3%.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

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]

Zugehörige Reaktionen

462
Reaktionsaufzeichnung erstellen

Verknüpfte Notizen

Wird geladen…