2,3-Epoxy-2,3-dihydro-1,4-naphthochinon

Naphth[2,3-b]oxirene-2,7-dione, 1a,7a-dihydro- · AKOS MSC-0135 · 2,3-Epoxytetralin-1,4-dione · Q200 1,4-NAPHTHOQUINONE 2,3-EPOXIDE · Naphtho[2,3-b]oxirene-2,7(1aH,7aH)-dione · 2,3-EPOXY-2,3-DIHYDRO-1,4-NAPHTHOQUINONE · 1a,7a-Dihydronaphth[2,3-b]oxirene-2,7-dione · 1a,7a-Dihydronaphtho[2,3-b]oxirene-2,7-dione

https://huagongshe.com/de/chemical/85844

Molekülstruktur von 2,3-Epoxy-2,3-dihydro-1,4-naphthochinon

Identifikatoren & physikalische Daten

CAS No.	15448-58-5
Summenformel	C10H6O3
Durchschnittliche Molmasse	174,15 g/mol
Monoisotopische Masse	174,03169405 g/mol
SMILES	O=C1c2ccccc2C(=O)C2OC12
InChIKey	TVVRFUOKLKGUKT-UHFFFAOYSA-N
PubChem CID	85844
ChEMBL	CHEMBL1492909
EC No.	239-465-1
DTXSID	DTXSID20934994
Lokaler Name	2,3-Epoxy-2,3-dihydro-1,4-naphthochinon

Chemische & physikalische Eigenschaften

XLogP	1
Polarare Oberfläche (TPSA)	46,7
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	0
Schwere Atome	13
Formalladung	0
Komplexität	256
Schmelzpunkt	133-134 °C
Siedepunkt	377.8±42.0 °C(Predicted)
Dichte	1.462±0.06 g/cm3(Predicted)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): 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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Zollcode	2932990090
Gefahrensymbole	Xi
hazard_note	Irritant