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Name |
6-Bromo-2-naphthaldehyde |
EINECS | N/A |
CAS No. | 170737-46-9 | Density | 1.552 g/cm3 |
PSA | 17.07000 | LogP | 3.41480 |
Solubility | N/A | Melting Point |
125.0 to 130.0 °C |
Formula | C11H7BrO | Boiling Point | 355.8 °C at 760 mmHg |
Molecular Weight | 235.08 | Flash Point | 125.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Naphthalenecarboxaldehyde, 6-bromo-; |
Article Data | 30 |
(6-bromo-2-naphthy)methanol
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
With Dess-Martin periodane In dichloromethane at 20℃; for 1h; | 100% |
With pyridinium chlorochromate In dichloromethane for 1h; Reflux; | 98% |
With pyridinium chlorochromate In dichloromethane for 5h; Reflux; | 95% |
methyl 6-bromo-2-naphthoate
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
Stage #1: methyl 6-bromo-2-naphthoate With diisobutylaluminium hydride In tetrahydrofuran at 0 - 20℃; Inert atmosphere; Stage #2: With pyridinium chlorochromate In dichloromethane at 60℃; for 6h; Inert atmosphere; | 95% |
Stage #1: methyl 6-bromo-2-naphthoate With diisobutylaluminium hydride In tetrahydrofuran at 0 - 20℃; for 12h; Stage #2: With pyridinium chlorochromate In dichloromethane for 5h; Reflux; | 95% |
With manganese dioxide; dibal In methanol; dichloromethane; toluene | 61% |
2,6-dibromonaphthalene
N,N-dimethyl-formamide
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
With n-butyllithium In tetrahydrofuran at -78℃; for 0.5h; Inert atmosphere; | 78% |
methyl 6-bromo-2-naphthoate
A
(6-bromo-2-naphthy)methanol
B
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
With diisobutylaluminium hydride In toluene at -78℃; Inert atmosphere; | A 35% B 57% |
2-Bromo-6-methoxynaphthalene
A
6-methoxynaphthalene-2-carbaldehyde
B
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
With n-butyllithium; sodium chloride In tetrahydrofuran; hexanes on silica gel; hexane; ethyl acetate; N,N-dimethyl-formamide | A n/a B 2.86 g (91%) |
6-bromo-2-naphthoic acid
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: borane-THF / tetrahydrofuran / 0 - 25 °C 2: pyridinium chlorochromate / dichloromethane / 25 °C View Scheme | |
Multi-step reaction with 3 steps 1: sulfuric acid / 7 h / Reflux 2: lithium aluminium tetrahydride / tetrahydrofuran / 2 h / -10 - 0 °C / Inert atmosphere 3: Dess-Martin periodane / dichloromethane / 2 h / 0 °C / Inert atmosphere View Scheme | |
Multi-step reaction with 2 steps 1: borane-THF / tetrahydrofuran / 0 - 20 °C 2: Dess-Martin periodane / dichloromethane / 0 - 20 °C View Scheme |
Conditions | Yield |
---|---|
Stage #1: C9H15NO5 With ytterbium(III) triflate In dichloromethane at 20℃; for 0.5h; Stage #2: 6-bromo-naphthalene-2-carboxaldehyde In dichloromethane at 20℃; Further stages.; | 100% |
6-bromo-naphthalene-2-carboxaldehyde
trimethyleneglycol
6-bromo-2-(1,3-dioxan-2-yl)naphthalene
Conditions | Yield |
---|---|
With zirconium(IV) chloride; orthoformic acid triethyl ester In dichloromethane at 20℃; for 2h; Inert atmosphere; | 96% |
6-bromo-naphthalene-2-carboxaldehyde
(6-bromo-2-naphthy)methanol
Conditions | Yield |
---|---|
With methanol; sodium tetrahydroborate at 0 - 20℃; for 4h; Inert atmosphere; | 96% |
2-(Z-3-chloroprop-2-enyl)-4,4,5,5-tetramethyl-1,2,3-dioxaborolane
6-bromo-naphthalene-2-carboxaldehyde
Conditions | Yield |
---|---|
With methanol; (2S)-2-((2-hydroxy-3-(triphenylsilyl)benzyl)amino)-2-(3-hydroxyadamantan-1-yl) 1-(isoindolin-2-yl)ethan-1-one; zinc dimethoxide In toluene at 22℃; for 14h; Glovebox; Inert atmosphere; Sealed tube; stereoselective reaction; | 95% |
The CAS registry number of 6-Bromo-2- aphthalenecarboxaldehyde is 170737-46-9. This chemical is also named as 2-Naphthalenecarboxaldehyde, 6-bromo-. In addition, its molecular formula is C11H7BrO and molecular weight is 235.08. Its systematic name is called 6-bromonaphthalene-2-carbaldehyde.
Physical properties about this chemical are: (1)ACD/LogP: 3.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.64; (4)ACD/LogD (pH 7.4): 3.64; (5)ACD/BCF (pH 5.5): 345.31; (6)ACD/BCF (pH 7.4): 345.31; (7)ACD/KOC (pH 5.5): 2282.71; (8)ACD/KOC (pH 7.4): 2282.71; (9)#H bond acceptors: 1#H bond donors: 0; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.7; (12)Molar Refractivity: 58.53 cm3; (13)Molar Volume: 151.3 cm3; (14)Surface Tension: 52 dyne/cm; (15)Density: 1.552 g/cm3; (16)Flash Point: 125.9 °C; (17)Enthalpy of Vaporization: 60.1 kJ/mol; (18)Boiling Point: 355.8 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1ccc2cc(Br)ccc2c1
(2)InChI: InChI=1/C11H7BrO/c12-11-4-3-9-5-8(7-13)1-2-10(9)6-11/h1-7H
(3)InChIKey: DLLDUYJRQNTEOR-UHFFFAOYAQ