7-Methoxy-2-naphthol

HCID 853173CAS 5060-82-2

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Grundinformationen

Standard-SMILES: COc1ccc2ccc(O)cc2c1
InChIKey: UNFNRIIETORURP-UHFFFAOYSA-N
Summenformel: C11H10O2
Durchschnittliche Molmasse: 174,2 g/mol
Monoisotopische Masse: 174,06807956

Namen und Bezeichner

Bevorzugter Name: 7-Methoxy-2-naphthol
IUPAC: 7-methoxynaphthalen-2-ol
Englischer Name: 7-Methoxy-2-naphthol
Summenformel: C11H10O2
Molmasse: 174.2

Namen und Synonyme

7-Methoxy-2-naphthol5060-82-2DTXSID80357408RefChem:310949DTXCID50308467629-282-97-methoxynaphthalen-2-ol2-Naphthalenol, 7-methoxy-MFCD00075494SCHEMBL2169057-(methyloxy)-2-naphthalenol2-hydroxy-7-methoxynaphthalene

Weitere Namen anzeigen

7-METHOXY-2-PHTHOL3-Methoxy-6-naphthol7-Methoxy-2-naphthalenol7-Methoxy-2-naphthol 98%7-Methoxy-2-naphthol, 97%, 97%

AKOS001434501CS-W017503DS-18565EN300-164822-Methoxy-7-naphthol2-Hydroxy-7-methoxynaphthalene; 3-Methoxy-6-naphthol; 7-Methoxy-2-naphthalenol; 7-Methoxy-2-naphthol; 7-Methoxy-ss-naphthol;7-methoxy-beta-naphtholAM20040581

Datenbank-Bezeichner

CAS: 5060-82-2
PubChem CID: 853173
DTXSID: DTXSID80357408
ChEMBL: CHEMBL4226925
EC Number: 629-282-9
Nikkaji: J770.043A

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,1
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 169

Physikochemische Eigenschaften

Schmelzpunkt: 116 · 116-119 °C(lit.)
Siedepunkt: 336.7 · 336.7±15.0 °C(Predicted)
Dichte: 1.193 · 1.193
storage temp.: Sealed in dry,Room Temperature
Aggregatzustand: Crystalline Powder or Chunks
pka: 9.45 · 9.45±0.40(Predicted)
Farbe: White to brown
BRN: 2207279 · 2207279
InChI: 1S/C11H10O2/c1-13-11-5-3-8-2-4-10(12)6-9(8)7-11/h2-7,12H,1H3
InChIKey: UNFNRIIETORURP-UHFFFAOYSA-N
SMILES: COc1ccc2ccc(O)cc2c1

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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

F: 8-9-23
wgk: 3
hs_code: 29071990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden7-Methoxy-2-naphthol may be used in the synthesis of new 1H-benzo[f]chromene derivatives. It may be used in the synthesis of 7-methoxy-2-naphthyl (MN)-derived xylosides in which the methoxy group served as a marker for NMR characterization and UV detection.