Basic information
- Name:
1H-Indole-3-ethanamine
- Superlist Name:
- Tryptamine
- CAS No.:
61-54-1
- Molecular Structure:
- Formula:
- C10H12N2
- Molecular Weight:
- 160.24
- Synonyms:
- Indole,3-(2-aminoethyl)- (8CI);2-(1H-Indol-3-yl)ethanamine;2-(3-Indolyl)ethylamine;3-(2-Aminoethyl)-1H-indole;3-(2-Aminoethyl)indole;3-Indoleethanamine;NSC 165212;Tryptamin;b-(3-Indolyl)ethylamine;
- EINECS:
- 200-510-5
- Density:
- 1.158 g/cm3
- Melting Point:
- 113-116 °C(lit.)
- Boiling Point:
- 378.766 °C at 760 mmHg
- Flash Point:
- 187.672 °C
- Appearance:
- White to orange crystalline powder
- Hazard Symbols:
Xi- Risk Codes:
- 20/21/22-36/37/38-41-37/38-22
- Safety Description:
- 24/25-36/37/39-36-26 Details
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Chemistry
Product Name: Tryptamine (CAS NO.61-54-1)
Molecular Formula: C10H12N2
Molecular Weight: 160.22g/mol
Mol File: 61-54-1.mol
Einecs: 200-510-5
Melting Point: 113-116 °C(lit.)
Boiling point: 378.8 °C at 760 mmHg
Storage Temperature: °C
Flash Point: 187.7 °C
Density: 1.157 g/cm3
Water Solubility: Negligible
Surface Tension: 54.7 dyne/cm
Enthalpy of Vaporization: 62.67 kJ/mol
Vapour Pressure: 6.14E-06 mmHg at 25°C
XLogP3-AA: 1.6
H-Bond Donor: 2
H-Bond Acceptor: 1
Structure Descriptors of Tryptamine (CAS NO.61-54-1):
IUPAC Name: 2-(1H-indol-3-yl)ethanamine
Canonical SMILES: C1=CC=C2C(=C1)C(=CN2)CCN
InChI: InChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2
InChIKey: APJYDQYYACXCRM-UHFFFAOYSA-N
Product Categories: Drug Intermediates; Indole; Indoles; Tryptamines; Amines; Heterocycles
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 100mg/kg (100mg/kg) | European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 453, 1974. | |
| mouse | LD50 | subcutaneous | 500mg/kg (500mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Dissertationes Pharmaceuticae et Pharmacologicae. Vol. 22, Pg. 313, 1970. |
| rat | LD50 | intraperitoneal | 223mg/kg (223mg/kg) | Journal of Pharmaceutical Sciences. Vol. 66, Pg. 1692, 1977. |
Safety Profile
Safety Information of Tryptamine (CAS NO.61-54-1):
Hazard Codes: Xi
Risk Statements: 20/21/22-36/37/38-41-37/38-22
20: Harmful by inhalation
21: Harmful in contact with skin
22: Harmful if swallowed
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
41: Risk of serious damage to eyes
Safety Statements: 24/25-36/37/39-36-26
24: Avoid contact with skin
25: Avoid contact with eyes
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
Specification
Tryptamine ,its CAS NO. is 61-54-1,the synonyms is (Amino-2 ethyl)-3 indole ; 1H-Indole-3-ethanamine ; 2-(3-Indolyl)ethylamine ; 3-(2-Aminoethyl)indole ; 5-22-10-00045 (Beilstein Handbook Reference) ; BRN 0125513 ; CCRIS 8959 ; EINECS 200-510-5 ; Indol-3-ethylamine .