1-Chlor-3-methylbut-2-en

1-Chloro-3-methyl-2-butene

HCID 10429CAS 503-60-6
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Grundinformationen

Standard-SMILES
CC(C)=CCCl
InChIKey
JKXQKGNGJVZKFA-UHFFFAOYSA-N
Summenformel
C5H9Cl
Durchschnittliche Molmasse
104,58 g/mol
Monoisotopische Masse
104,03927797

Namen und Bezeichner

Bevorzugter Name
1-Chloro-3-methyl-2-butene
IUPAC
1-chloro-3-methylbut-2-ene
Lokaler Name
1-Chlor-3-methylbut-2-en
Englischer Name
1-Chloro-3-methyl-2-butene
Summenformel
C5H9Cl
Molmasse
104.58

Namen und Synonyme

1-CHLORO-3-METHYL-2-BUTENE503-60-61-Chloro-3-methylbut-2-enePrenyl chloride2-Butene, 1-chloro-3-methyl-3,3-Dimethylallyl chloride3-Methyl-2-butenyl chloride3-Methylcrotyl chloride1-chloro-3-methyl-but-2-eneKMT7V9LLBRUNII-KMT7V9LLBRHSDB 6129
Weitere Namen anzeigen
Isopentenyl chloride-2-buteneIsoprenylchloridechloroisopentylene1-Chloro-3-methyl-2-3-methylcrotylchloride
gamma,gamma-Dimethylallyl chlorideIsoprenyl chlorideEINECS 207-972-74-Chloro-2-methyl-2-buteneMFCD00000982.gamma.,.gamma.-Dimethylallyl chloride1-Chloro-3-methyl-2-butene (>85%)prenylchloride

Datenbank-Bezeichner

CAS
503-60-6
PubChem CID
10429
DTXSID
DTXSID7060120
UNII
KMT7V9LLBR
EC Number
207-972-7
Nikkaji
J29.181A

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,3
Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
0
Frei drehbare Bindungen
1
Schwere Atome
6

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Halogenated Aliphatics, Unsaturated
SpringerMaterials PropertiesDensity
Density0.9273 @ 20 °C/4 °C
SolubilityINSOL IN WATER; SOL IN ALCOHOL, ETHER, ACETONE; VERY SOL IN CHLOROFORM
Boiling Point109 °C @ 760 MM HG
Refractive IndexINDEX OF REFRACTION: 1.4485 @ 20 °C/D

Physikochemische Eigenschaften

Siedepunkt
58 · 58-59 °C/120 mmHg (lit.)
Dichte
0.928 g/mL · 0.928 g/mL at 25 °C (lit.)
Brechungsindex
20 · n20/D 1.4488(lit.)
Flammpunkt
56 °F · 56 °F
storage temp.
2 · 2-8°C
Löslichkeit
soluble in Chloroform, Ethyl Acetate

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H225 (98.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 60 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: 2-Butene, 1-chloro-3-methyl-

Status: Active Update: 18-10-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/20883

Hazards SummaryA skin and severe eye irritant; [MSDSonline]
Hazard Classes and CategoriesFlam. Liq. 2 (98.3%)

Toxikologische Informationen

Toxicity DataLC50 (rat) = 3,580 mg/m3

Sicherheitsdaten

wgk
3
tsca
TSCA listed
ridadr
UN 1993 3/PG 2
hs_code
29032990
risk_code
11-36/37/38
hazard_code
F,Xi

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing Information · 6 Einträge

2-Butene, 1-chloro-3-methyl-: ACTIVE

THE PREPN & USE OF 5-OXA-2-METHYL-7-PHENYL-2-HEPTENE IN PERFUME COMPOSITIONS IS DESCRIBED.

THE INSECT ATTRACTANT CONTAINS ADDUCTS OF ISOPRENE & HYDROCHLORIC ACID, WHICH ARE EFFECTIVE TO BEE & HORSEFLY. 100 ML ISOPRENE IS TREATED WITH 0.55 MOLE EQUIV OF HYDROCHLORIC ACID @ 0 °C TO GIVE THE ADDUCT, WHICH IS A MIXT CONTAINING 63% 3-CHLORO-3-METHYL-1-BUTENE, 32% 1-CHLORO-3-METHYL-2-BUTENE, & OTHER MINOR COMPONENTS.

SUBSTITUTED CYCLOHEXANE OR CYCLOHEXENE ALC OR KETONES ARE PREPD & USED AS ODOR-MODIFYING INGREDIENTS IN PERFUMES.

TERPENE ALCOHOLS ARE ANTIFOULING AGENTS.

TERPENE CARBONYLS AS BACTERICIDES AND FUNGICIDES

Anwendungen

Verwenden1-Chloro-3-methyl-2-butene is used in the synthesis of geraniol. It is also used as an alkylating agent and as a reagent in hyperforin. Further, it is used as an antibiotic to inhibit growth of tumor cells.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

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