2-Chlorbenzophenon

Methanone, (2-chlorophenyl)phenyl-

HCID 78838CAS 51330-06-4

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Grundinformationen

Standard-SMILES: O=C(c1ccccc1)c1ccccc1Cl
InChIKey: VMHYWKBKHMYRNF-UHFFFAOYSA-N
Summenformel: C13H9ClO
Durchschnittliche Molmasse: 216,66 g/mol
Monoisotopische Masse: 216,03419259

Überblick

2-Chlorobenzophenone is a member of benzophenones.

Namen und Bezeichner

Bevorzugter Name: Methanone, (2-chlorophenyl)phenyl-
IUPAC: (2-chlorophenyl)-phenylmethanone
Lokaler Name: 2-Chlorbenzophenon
Englischer Name: (2-Chlorophenyl)phenyl-methanone
Summenformel: C13H9ClO
Molmasse: 216.66

Namen und Synonyme

2-Chlorobenzophenone5162-03-8o-ChlorobenzophenoneMethanone, (2-chlorophenyl)phenyl-Benzophenone, 2-chloro-(2-Chlorophenyl)phenylmethanone2-Chlorobenyl phenyl ketoneDU8B664MRJDTXSID6063721EINECS 225-936-9NSC 62529NSC-62529

Weitere Namen anzeigen

2-CBPorobenzophenoneRARECHEM AM UC 06022-chloro-benzophenon(2-Chlorophenyl)phen2-ChlorobenozophenoneLABOTEST-BB LT00159660

AI3-22112CLOTRIMAZOLE IMPURITY E [EP IMPURITY]51330-06-4CLOTRIMAZOLE IMPURITY E (EP IMPURITY)RefChem:811635DTXCID2041044Benzophenone, 2-chloro-(6CI,7CI,8CI)225-936-9

Datenbank-Bezeichner

CAS: 51330-06-4、5162-03-8
PubChem CID: 78838
DTXSID: DTXSID6063721
ChEBI: CHEBI:228404
UNII: DU8B664MRJ
EC Number: 225-936-9
Nikkaji: J5.201I

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 15
Formalladung: 0
Komplexität: 221

Physikochemische Eigenschaften

Schmelzpunkt: 44 · 44-47 °C(lit.)
Siedepunkt: 330 °C · 330 °C(lit.)
Dichte: 1 · 1,18g/cm
Brechungsindex: 1.526 · 1.5260 (estimate)
Flammpunkt: 230 °F · >230 °F
storage temp.: 2 · 2-8°C
Löslichkeit: Chloroform (Sparingly), Methanol (Slightly)
Aggregatzustand: Solid
Farbe: White to Off-White
BRN: 1869594 · 1869594
InChI: InChI=1S/C13H9ClO/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10/h1-9H
InChIKey: VMHYWKBKHMYRNF-UHFFFAOYSA-N
SMILES: C(C1=CC=CC=C1Cl)(C1=CC=CC=C1)=O
CAS Datenbank: 5162 · 5162-03-8(CAS DataBase Reference)
NIST chemische Informationen: Methanone, (2-chlorophenyl)phenyl-(5162-03-8)
EPA chemische Informationen: Methanone, (2-chlorophenyl)phenyl- (5162-03-8)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (27.3%): Harmful if swallowed [Warning Acute toxicity, oral]

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

Aggregated GHS information provided per 11 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory InformationMethanone, (2-chlorophenyl)phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesAcute Tox. 4 (27.3%)

Sicherheitsdaten

wgk: 3
tsca: TSCA listed
hs_code: 29143990
RTECS-Nr.: PC4945633
risk_code: 36/37/38-20/21/22
hazard_code: Xi,Xn
hazard_note: Irritant
safety_code: 37/39-26-24/25-36
Speicherklasse: 11 - Combustible Solids

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationMethanone, (2-chlorophenyl)phenyl-: ACTIVE

Anwendungen

Verwenden(2-Chlorophenyl)phenyl-methanone is a metabolite of Clofedanol (C586920). Chlorobenzophenone is also used as a catalyst in the photocrosslinking of polyethylenes.