Dibenzo[b,f]cycloheptan-1-on

Dibenzosuberone

HCID 14589CAS 1210-35-1
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Grundinformationen

Standard-SMILES
O=C1c2ccccc2CCc2ccccc21
InChIKey
BMVWCPGVLSILMU-UHFFFAOYSA-N
Summenformel
C15H12O
Durchschnittliche Molmasse
208,25 g/mol
Monoisotopische Masse
208,088815

Namen und Bezeichner

Bevorzugter Name
Dibenzosuberone
IUPAC
tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-one
Lokaler Name
Dibenzo[b,f]cycloheptan-1-on
Englischer Name
Dibenzosuberone
Summenformel
C15H12O
Molmasse
208.26

Namen und Synonyme

Dibenzosuberone1210-35-1DibenzocycloheptenoneDibenzosuberan-5-oneDibenzsuberone2,3:6,7-Dibenzosuberone5H-Dibenzo[a,d]cyclohepten-5-one, 10,11-dihydro-Dibenzo(a,d)cycloheptadien-5-one10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-oneDibenzo[a,d]cycloheptadien-5-oneDTXSID4049400Dibenzo(a,d)cyclohepta(1,4)dien-5-one
Weitere Namen anzeigen
10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-onedienone5-DIBENZOSUBERONEDibenzocycloheptanoneDDCONSC 49727DibezosuberoneDIBENZOSUBERONE98%
10,11-Dihydrodibenzo(a,d)cyclohepten-5-one8ETK71TH0H5H-Dibenzo(a,d)cyclohepten-5-one, 10,11-dihydro-10,11-DIHYDRO-5H-DIBENZO(A,D)CYCLOHEPTEN-5-ONENSC-49727DTXCID4029359Dibenzo[a,d]cyclohepta[1,4]dien-5-one10,11-Dihydrodibenzo[a,d]cyclohepten-5-one

Datenbank-Bezeichner

CAS
1210-35-1
PubChem CID
14589
DTXSID
DTXSID4049400
ChEMBL
CHEMBL1905787
UNII
8ETK71TH0H
EC Number
214-912-3
Nikkaji
J149.830D

Eigenschaften

Berechnete Struktureigenschaften

XLogP
4
Polarare Oberfläche (TPSA)
17,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
0
Schwere Atome
16

Physikochemische Eigenschaften

Schmelzpunkt
32 · 32-34 °C(lit.)
Siedepunkt
148 °C0.3 · 148 °C0.3 mm Hg(lit.)
Dichte
1.156 g/mL · 1.156 g/mL at 25 °C(lit.)
Brechungsindex
20 · n20/D 1.6332(lit.)
Flammpunkt
230 °F · >230 °F
storage temp.
30 °C · Store below +30°C.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 85.1% (63 of 74) of all reports.

Warning

H319 (13.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 74 reports by companies from 6 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 63 of 74 reports by companies.；There are 4 notifications provided by 11 of 74 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

Regulatory Information · 3 Einträge

Chemical: 5H-Dibenzo[a,d]cyclohepten-5-one, 10,11-dihydro-

Status: Active Update: 07-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/18967

5H-Dibenzoa,dcyclohepten-5-one, 10,11-dihydro-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesEye Irrit. 2 (13.5%)

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: 5H-Dibenzo[a,d]cyclohepten-5-one, 10,11-dihydro-

Status: Active Update: 07-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/18967

5H-Dibenzoa,dcyclohepten-5-one, 10,11-dihydro-: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29143900
RTECS-Nr.
HP1149700
risk_code
36/37/38
Toxizität
LD50 orally in Rabbit: 2511 mg/kg LD50 dermal Rat > 2000 mg/kg

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing Information5H-Dibenzo[a,d]cyclohepten-5-one, 10,11-dihydro-: ACTIVE

Anwendungen

VerwendenDibenzosuberone is a potential antidepressant compound. It is used in the synthesis of amitriptyline.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

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]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

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