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| CAS No.: | 5470-37-1 |
|---|---|
| Name: | HARMANE-1,2,3,4-TETRAHYDRO-3-CARBOXYLIC ACID |
| Article Data: | 20 |
| Molecular Structure: | |
|
|
|
| Formula: | C13H14 N2 O2 |
| Molecular Weight: | 230.266 |
| Synonyms: | 1,2,3,4-Tetrahydro-3-carboxyharmane;1-Methyl-1,2,3,4-Tetrahydropyrido[3,4-b]indole-3-carboxylic acid;1-Methyl-1,2,3,4-tetrahydro-b-carboline-3-carboxylic acid; NSC 26225; Tetrahydroharman-3-carboxylicacid |
| Density: | 1.301g/cm3 |
| Melting Point: | 242-243 °C (decomp) |
| Boiling Point: | 488°Cat760mmHg |
| Flash Point: | 248.9°C |
| Hazard Symbols: |
 Xi
|
| Safety: | Mutation data reported. When heated to decomposition it emits toxic vapors of NOx. |
| PSA: | 65.12000 |
| LogP: | 2.15660 |
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Chemistry
Molecular Formula: C13H14N2O2
Molecular Weight: 230.27g/mol
Density: 1.301g/cm3
Boiling Point: 488°C at 760mmHg
Flash Point: 248.9°C
Storage temperature: −20°C
Freely Rotating Bonds: 1
Polar Surface Area: 34.47 Å2
Index of Refraction: 1.654
Molar Refractivity: 64.86 cm3
Molar Volume: 176.9 cm3
Polarizability: 25.71 ×10-24 cm3
Surface Tension: 56.5 dyne/cm
Enthalpy of Vaporization: 79.42 kJ/mol
Vapour Pressure: 2.44E-10 mmHg at 25°C
The Cas Register Number of 2,3,4,9-Tetrahydro-1-methyl-1h-pyrido-(3,4-b)indole-3-carboxylic acid is 5470-37-1.The chemical synonyms of 2,3,4,9-Tetrahydro-1-methyl-1h-pyrido-(3,4-b)indole-3-carboxylic acid (CAS NO.5470-37-1) are 1H-pyrido[3,4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl- ; 1-methyl-1,2,3,4-tetrahydro-beta-carboline-3-carboxylic acid ; 1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid ; 1,2,3,4-Tetrahydroharmane-3-carboxylic acid ; 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl- ; 1H-Pyrido[3, 4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl- ; 1-Methyl-tetrahydro-beta-carboline-3-carboxylic acid ; beta-carboline-3-carboxylic acid, 1,2,3,4-tetrahydro-1-methyl- .The molecular structure of 2,3,4,9-Tetrahydro-1-methyl-1h-pyrido-(3,4-b)indole-3-carboxylic acid (CAS NO.5470-37-1) is.png)
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Uses
2,3,4,9-Tetrahydro-1-methyl-1h-pyrido-(3,4-b)indole-3-carboxylic acid (CAS NO.5470-37-1) is used in organic synthesis.
Toxicity Data With Reference
| 1. | mic-sat 2 µLg/plate/0.3H | FCTOD7 Food and Chemical Toxicology. 38 (2000),7. |
Safety Profile
Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
Hazard Codes: 
Xi
HazardClass: 6.1(b)
Specification
The compounds of the present invention which lack an element of symmetry exist as optical antipodes and as the racemic forms thereof. The optical antipodes may be prepared from the corresponding racemic forms by standard optical resolution techniques, involving, for example, the separation of diastereomeric salts of those instant compounds characterized by the presence of a basic amino group and an optically active acid, or by the synthesis from optically active precursors.