7-Hydroxy-4-methyl-1-indanone

7-Hydroxy-4-Methyl-2,3-dihydro-1H-inden-1-one · 111165 · 4-Methyl-7-hydroxy-1-indanone · 7-Hydroxy-4-methylindan-1-one · 4-Methyl-7-hydroxyindan-1-one · 7-Hydroxy-5-methyl-indan-1-one · 7-HYDROXY-4-METHYL-1-INDANONE 97 · 6-Hydroxy-2,3-dimethyl-benzaldehyde

https://huagongshe.com/de/chemical/12436244

Molekülstruktur von 7-Hydroxy-4-methyl-1-indanone

Identifikatoren & physikalische Daten

CAS No.	67901-82-0
Summenformel	C10H10O2
Durchschnittliche Molmasse	162,18 g/mol
Monoisotopische Masse	162,06807956 g/mol
SMILES	Cc1ccc(O)c2c1CCC2=O
InChIKey	FXEWVKMVYBQMET-UHFFFAOYSA-N
PubChem CID	12436244
EC No.	623-153-0
DTXSID	DTXSID60498202

Chemische & physikalische Eigenschaften

XLogP	2,2
Polarare Oberfläche (TPSA)	37,3
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	0
Schwere Atome	12
Formalladung	0
Komplexität	200
Schmelzpunkt	109-112 °C (lit.)
Siedepunkt	339.3±41.0 °C(Predicted)
Dichte	1.250±0.06 g/cm3(Predicted)
Lagerbedingungen	Inert atmosphere,Room Temperature
Aggregatzustand	solid
pKa (Säurekonstante)	10.59±0.20(Predicted)
InChI	1S/C10H10O2/c1-6-2-4-8(11)10-7(6)3-5-9(10)12/h2,4,11H,3,5H2,1H3
InChIKey	FXEWVKMVYBQMET-UHFFFAOYSA-N
SMILES	Cc1ccc(O)c2C(=O)CCc12

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Wassergefährdungsklasse (WGK)	2
R-Sätze (R)	22-36
Gefahrensymbole	Xn
Sicherheitshinweise (S)	26
Lagerklasse	11 - Combustible Solids
Gefahrenklasse	Acute Tox. 4 OralEye Irrit. 2