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HCID 90685Erstellt: 23. Oktober 2026

Benzaldehyde, 2-methoxy-5-nitro-

AKOS B028867 · 5-Nitro-o-anisaldehyde · 2-METHOXY-5-NITROBENZALDEHYDE · 2-methoxy-5-nitro-benzaldehyd · Benzaldehyde, 2-methoxy-5-nitro- · 4-(4-morpholinyl)-6-[[4-(phenylmethyl)-1-piperazinyl]methyl]-1,3,5-triazin-2-amine

https://huagongshe.com/de/chemical/90685

Molekülstruktur von Benzaldehyde, 2-methoxy-5-nitro-

Identifikatoren & physikalische Daten

CAS No.25016-02-8
SummenformelC8H7NO4
Durchschnittliche Molmasse181,15 g/mol
Monoisotopische Masse181,0375077 g/mol
SMILESCOc1ccc([N+](=O)[O-])cc1C=O
InChIKeyYWVSKFXYEWMHEO-UHFFFAOYSA-N
PubChem CID90685
EC No.811-106-9
DTXSIDDTXSID1067041

Chemische & physikalische Eigenschaften

XLogP1,6
Polarare Oberfläche (TPSA)72,1
H-Brücken-Donoren0
H-Brücken-Akzeptoren4
Frei drehbare Bindungen2
Schwere Atome13
Formalladung0
Komplexität201
Schmelzpunkt89-92 °C (lit.)
Siedepunkt336.7±27.0 °C(Predicted)
Dichte1.322±0.06 g/cm3(Predicted)
LagerbedingungenInert atmosphere,Room Temperature
Löslichkeitvery soluble in Dimethylformamide
Aggregatzustandpowder to crystal
FarbeWhite to Light yellow to Light orange
InChI1S/C8H7NO4/c1-13-8-3-2-7(9(11)12)4-6(8)5-10/h2-5H,1H3
InChIKeyYWVSKFXYEWMHEO-UHFFFAOYSA-N
SMILESCOc1ccc(cc1C=O)[N+]([O-])=O
CAS Datenbank25016-02-8
EPA chemische InformationenBenzaldehyde, 2-methoxy-5-nitro- (25016-02-8)

Sicherheit & Vorschriften

GHS-EinstufungWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Wassergefährdungsklasse (WGK)3
TSCA-Inventar-StatusTSCA listed
Zollcode2913000090
Lagerklasse13 - Non Combustible Solids