3-Chloranisol

3-Chloroanisole

HCID 17833CAS 2845-89-8

Grundinformationen

Standard-SMILES
COc1cccc(Cl)c1
InChIKey
YUKILTJWFRTXGB-UHFFFAOYSA-N
Summenformel
C7H7ClO
Durchschnittliche Molmasse
142,58 g/mol
Monoisotopische Masse
142,0185425

Namen und Bezeichner

Bevorzugter Name
3-Chloroanisole
IUPAC
1-chloro-3-methoxybenzene
Lokaler Name
3-Chloranisol
Englischer Name
3-Chloroanisole
Summenformel
C7H7ClO
Molmasse
142.58

Namen und Synonyme

3-Chloroanisole2845-89-8Benzene, 1-chloro-3-methoxy-HQ8W659XSKDTXSID7062667RefChem:93501DTXCID9037820220-642-71-CHLORO-3-METHOXYBENZENEm-ChloroanisoleAnisole, m-chloro-1-chloro-3-methoxy-benzene
Weitere Namen anzeigen
1-chloro-3-methoxy-benzenm-chlorophenylmethyletheroroanisoL3-Chloroanisole>
MFCD000005913-Chloromethoxybenzene3-methoxyphenyl chloride3-chloroanisol20032-78-4meta-Chloroanisole3-anisolyl chlorideEINECS 220-642-7

Datenbank-Bezeichner

CAS
2845-89-8
PubChem CID
17833
DTXSID
DTXSID7062667
UNII
HQ8W659XSK
EC Number
220-642-7
Nikkaji
J5.167E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3
Polarare Oberfläche (TPSA)
9,2 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
9

Experimentelle und physikochemische Eigenschaften

Kovats Retention Index · 3 Einträge

1072;1081;1084;1080;1085;1092;1068

1110.8;1126

1582;1588;1604;1618;1623;1628

Physikochemische Eigenschaften

Schmelzpunkt
25 °C · 25°C
Siedepunkt
193 °C · 193 °C (lit.)
Dichte
1.164 g/mL · 1.164 g/mL at 25 °C (lit.)
Brechungsindex
20 · n20/D 1.536(lit.)
Flammpunkt
164 °F · 164 °F
storage temp.
Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.

Warning

H227 (20%): Combustible liquid [Warning Flammable liquids];H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (20%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (80%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (80%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (20%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (80%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 5 reports by companies.;There are 4 notifications provided by 4 of 5 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 4 (20%);Acute Tox. 4 (20%);Acute Tox. 4 (20%);Skin Irrit. 2 (80%);Eye Irrit. 2A (80%);Acute Tox. 4 (20%);STOT SE 3 (80%)

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29093090
hazard_code
Xi
hazard_note
Irritant
safety_code
23-24/25

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationBenzene, 1-chloro-3-methoxy-: INACTIVE

Anwendungen

Verwenden3-Chloroanisole was employed as starting reagent in the regioselective synthesis of 4- and 7-alkoxyindoles. It was also employed as electrolyte additive for the overcharging protection of Li-ion cell.

Anbieter50 Anbieter

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