2,3-Dimethoxybenzaldehyd

2,3-Dimethoxybenzaldehyde

HCID 66581CAS 86-51-1
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Grundinformationen

Standard-SMILES
COc1cccc(C=O)c1OC
InChIKey
JIVGSHFYXPRRSZ-UHFFFAOYSA-N
Summenformel
C9H10O3
Durchschnittliche Molmasse
166,17 g/mol
Monoisotopische Masse
166,06299418

Überblick

O-Veratraldehyde is a dimethoxybenzene.

Namen und Bezeichner

Bevorzugter Name
2,3-Dimethoxybenzaldehyde
IUPAC
2,3-dimethoxybenzaldehyde
Lokaler Name
2,3-Dimethoxybenzaldehyd
Englischer Name
2,3-Dimethoxybenzaldehyde
Summenformel
C9H10O3
Molmasse
166.17

Namen und Synonyme

2,3-Dimethoxybenzaldehydeo-VeratraldehydeBenzaldehyde, 2,3-dimethoxy-5,6-DimethoxybenzaldehydeVERATRALDEHYDE, O-EINECS 201-677-78ALP3SY00LNSC 403661AI3-00141NSC-6314NSC-51953UNII-8ALP3SY00L
Weitere Namen anzeigen
2-VERATRALDEHYDE4-DiethoxybenzeneAKOS BBS-00003161OrthoveratraldehydeO-VERATRIC ALDEHYDE2,3-DimethoxybenzaldLABOTEST-BB LT009323253-DiMethoxybenzaldehyde
NSC-403661DTXSID802353332-Hydroxy-3-methoxybenzaldehyde, methyl etheroVeratraldehydeoVeratraldehyde (8CI)RefChem:81799o-Veratraldehyde (8CI)Benzaldehyde, 2,3dimethoxy

Datenbank-Bezeichner

CAS
86-51-1
PubChem CID
66581
DTXSID
DTXSID80235333
ChEMBL
CHEMBL3039102
ChEBI
CHEBI:228697
UNII
8ALP3SY00L
EC Number
201-677-7
Nikkaji
J96.722J

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,1
Polarare Oberfläche (TPSA)
35,5 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
3
Schwere Atome
12

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Benzaldehydes
Physical DescriptionOff-white or yellow moist crystalline powder; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
48 · 48-52 °C (lit.)
Siedepunkt
137 °C/12 · 137 °C/12 mmHg (lit.)
Dichte
1.1708 · 1.1708 (rough estimate)
Brechungsindex
1.55 · 1.5500 (estimate)
Flammpunkt
230 °F · >230 °F
storage temp.
Keep in dark place,Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (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 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: Benzaldehyde, 2,3-dimethoxy-

Benzaldehyde, 2,3-dimethoxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS] See Vanillin, Syringaldehyde, and 2-Methoxybenzaldehyde.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk
3
hs_code
29124900
RTECS-Nr.
CU5732000
risk_code
36/37/38
hazard_code
Xi
hazard_note
Irritant

Chemie und Industrie

Anwendungen · 2 Einträge

Beschreibung2,3-Dimethoxybenzaldehyde, commonly known as o-veratrol, is an important aromatic aldehyde compound. Its structure is characterized by two methoxy substituents and one aldehyde group at the ortho (2 and 3) positions of the benzene ring. Due to its unique chemical structure, this compound occupies a central position in the field of pharmaceutical intermediates, especially as a key precursor in the synthesis of berberine. Furthermore, it possesses significant biological activities, such as antifungal and antiviral effects.

Verwenden2,3-Dimethoxybenzaldehyde possess antifungal activity of redox-active benzaldehydes that target cellular antioxidation. It could function as chemosensitizing agents in concert with conventional drugs to improve antifungal efficacy.

Vor- und nachgelagerte Produkte

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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]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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