Products Categories
| CAS No.: | 487-89-8 |
|---|---|
| Name: | Indole-3-carboxaldehyde |
| Article Data: | 197 |
| Molecular Structure: | |
|
|
|
| Formula: | C9H7NO |
| Molecular Weight: | 145.161 |
| Synonyms: | 3-Indolecarboxaldehyde;.beta.-Indolylaldehyde;5-21-08-00246 (Beilstein Handbook Reference);1H-Indole-3-carboxaldehyde;beta-Indolylaldehyde;3-Indolealdehyde;246045-99-8;3-Formylindole;1H-indole-3-carbaldehyde;3-Indolecarbaldehyde; |
| EINECS: | 207-665-8 |
| Density: | 1.278 g/cm3 |
| Melting Point: | 193-198 °C(lit.) |
| Boiling Point: | 339.1 °C at 760 mmHg |
| Flash Point: | 166.8 °C |
| Solubility: | Insoluble in water. |
| Appearance: | off-white to beige-brown crystalline powder |
| Hazard Symbols: |
 Xi
|
| Safety: | 22-24/25 |
| PSA: | 32.86000 |
| LogP: | 1.98040 |
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 118481-30-4
1-(methanesulfonyl)-1H-indole-3-carboxaldehyde
- 487-89-8
Indole-3-carboxaldehyde
| Conditions | Yield |
|---|---|
| With tetrabutyl ammonium fluoride In tetrahydrofuran for 1h; Heating; | 100% |
- 57476-50-3
1-tert-butoxycarbonyl-3-formylindole
- 487-89-8
Indole-3-carboxaldehyde
| Conditions | Yield |
|---|---|
| With potassium phosphate In methanol at 120℃; under 5171.62 Torr; for 0.0333333h; Microwave irradiation; | 100% |
| With sodium carbonate In 1,2-dimethoxyethane; water for 1.5h; Heating; | 98% |
| In various solvent(s) at 150℃; for 0.0833333h; microwave irradiation; | 96% |
- 22948-94-3
1-acetyl-3-indolylcarbaldehyde
- 487-89-8
Indole-3-carboxaldehyde
| Conditions | Yield |
|---|---|
| With polymer-supported potassium thiophenolate In tetrahydrofuran; methanol at 20℃; for 3h; | 99% |
- 487-89-8
Indole-3-carboxaldehyde
| Conditions | Yield |
|---|---|
| With lithium diisopropyl amide In tetrahydrofuran; hexane at 40 - 45℃; for 2h; | 99% |
| With n-butyllithium; diisopropylamine In tetrahydrofuran; hexanes at -78 - 45℃; for 2h; Inert atmosphere; | 99% |
| Conditions | Yield |
|---|---|
| With trichlorophosphate at 0 - 35℃; for 2.08333h; | 98% |
| With trichlorophosphate at 0 - 55℃; for 2h; | 98% |
| Stage #1: N,N-dimethyl-formamide With trichlorophosphate at 0 - 2℃; for 0.5h; Vilsmeier-Haack Formylation; Stage #2: indole at 35℃; for 1h; Vilsmeier-Haack Formylation; Stage #3: With water; sodium hydroxide for 0.5h; Reflux; | 98% |
| Conditions | Yield |
|---|---|
| With 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione In dimethyl sulfoxide for 8h; Ambient temperature; | 98% |
| With 1,3,6,8-tetra-n-butylpyrimido<5,4-g>pteridine-2,4,5,7(1H,3H,6H,8H)-tetrone 10-oxide In acetonitrile for 0.0333333h; Irradiation; | 90% |
| With LACTIC ACID; dihydrogen peroxide at 30℃; for 7h; | 87% |
| Conditions | Yield |
|---|---|
| With chloro-trimethyl-silane; 4-(trifluoromethyl)benzoic anhydride; silver trifluoromethanesulfonate; titanium tetrachloride In dichloromethane for 20h; Ambient temperature; | 88% |
| Conditions | Yield |
|---|---|
| With copper(II) choride dihydrate; water In acetonitrile at 75℃; for 1h; | 88% |
| With iron(III) chloride In N,N-dimethyl-formamide at 25℃; for 0.666667h; sonication; | 76% |
- 141692-10-6
(3-formylindol-4-yl)thallium (III) bistrifluoroacetate
- 78-94-4
methyl vinyl ketone
A
- 487-89-8
Indole-3-carboxaldehyde
| Conditions | Yield |
|---|---|
| palladium diacetate In N,N-dimethyl-formamide at 120℃; | A n/a B 86% |
| Conditions | Yield |
|---|---|
| With pyridinium chlorochromate In N,N-dimethyl-formamide at 100℃; for 0.5h; Reagent/catalyst; | 85% |
| Stage #1: 3-(Dimethylaminomethyl)indole With iodine; sodium carbonate In 1,4-dioxane at 20℃; for 12h; Stage #2: With water In 1,4-dioxane for 3h; Reagent/catalyst; Solvent; | 81% |
| With hexamethylenetetramine; water; propionic acid | |
| Multi-step reaction with 2 steps 1: PhIO/TMSN3 2: water View Scheme |
What can I do for you?
Get Best Price
Chemistry
Molecular Structure of 3-Formylindole (CAS No.487-89-8):
Molecular Formula: C9H7NO
Molecular Weight: 145.157980
IUPAC Name: 1H-Indole-3-carbaldehyde
CAS No: 487-89-8
EINECS: 207-665-8
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 32.86 Å2
Index of Refraction: 1.729
Molar Refractivity: 45.28 cm3
Molar Volume: 113.5 cm3
Surface Tension: 59.8 dyne/cm
Density: 1.278 g/cm3
Flash Point: 166.8 °C
Enthalpy of Vaporization: 58.25 kJ/mol
Boiling Point: 339.1 °C at 760 mmHg
Vapour Pressure: 9.42E-05 mmHg at 25°C
Melting Point: 193-198 °C(lit.)
Storage Temp.: Keep Cold
Sensitive: Air Sensitive
Appearance: Off-white to beige-brown crystalline powder
Classification Code: Drug/Therapeutic Agent
Product Categories: Aldehyde;Aldehydes;blocks;IndolesOxindoles;indole derivative;Indoles and derivatives;Pyrroles Indoles;Indoles;Simple Indoles;Pyrroles Indoles;Building Blocks;Heterocyclic Building Blocks
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LDLo | intraperitoneal | 600mg/kg (600mg/kg) | AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" BEHAVIORAL: ANTICONVULSANT BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) | Pharmaceutical Chemistry Journal Vol. 6, Pg. 33, 1972. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Safety Information of 3-Formylindole (CAS No.487-89-8):
Hazard Codes: 
Xi
Safety Statements: 22-24/25
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
RTECS: NL5993600
F: 9-23
Hazard Note: Irritant/Keep Cold
HazardClass: IRRITANT
HS Code: 29339990
Specification
3-Formylindole (CAS No.487-89-8), it also can be called Indol-3-carboxaldehyde ; Indole-3-aldehyde ; beta-Indolylaldehyde ; 1H-Indole-3-carboxaldehyde .
Storage of 3-Formylindole (487-89-8): Store in a cool dry place. Keep container closed.