6-Chlorchroman-4-on

6-chloro-2,3-dihydrochroMen-4-one · 6-Chloro-4-chrom · BUTTPARK 35\07-32 · 6-CHLOROCHROMANONE · TIMTEC-BB SBB003732 · 6-CHLORO-4-CHROMANONE · 6-CHLOROCHROMAN-4-ONE · 6-Chloro-4-chromanone-1

https://huagongshe.com/de/chemical/95273

Identifikatoren & physikalische Daten

CAS No.	37674-72-9
Summenformel	C9H7ClO2
Durchschnittliche Molmasse	182,6 g/mol
Monoisotopische Masse	182,01345714 g/mol
SMILES	O=C1CCOc2ccc(Cl)cc21
InChIKey	LLTDYHFVIVSQPJ-UHFFFAOYSA-N
PubChem CID	95273
EC No.	253-611-1
DTXSID	DTXSID00191109
Lokaler Name	6-Chlorchroman-4-on

Chemische & physikalische Eigenschaften

XLogP	2
Polarare Oberfläche (TPSA)	26,3
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	0
Schwere Atome	12
Formalladung	0
Komplexität	193
Schmelzpunkt	97-102 °C(lit.)
Siedepunkt	322.0±42.0 °C(Predicted)
Dichte	1.345±0.06 g/cm3(Predicted)
Lagerbedingungen	Sealed in dry,Room Temperature
Löslichkeit	Soluble in solvents.
Aggregatzustand	powder to crystal
Farbe	White to Yellow to Orange
BRN	124218
InChI	1S/C9H7ClO2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2
InChIKey	LLTDYHFVIVSQPJ-UHFFFAOYSA-N
SMILES	Clc1ccc2OCCC(=O)c2c1
CAS Datenbank	37674-72-9(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Wassergefährdungsklasse (WGK)	2
Zollcode	29329990
R-Sätze (R)	22-36/37/38-20/21/22
Gefahrensymbole	Xn
Sicherheitshinweise (S)	26-36-24/25
Lagerklasse	11 - Combustible Solids
Gefahrenklasse	Acute Tox. 4 Oral

Anwendungen & Verwendung

Verwenden

6-Chlorochroman-4-one is used as chemical, organic intermediates for pharmaceuticals.