1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid
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1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid
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CAS No:
5470-37-1
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Formula:
C13H14N2O2
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Chemical Name:
1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid
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Synonyms:
1H-Pyrido[3,4-b]indole-3-carboxylic acid,2,3,4,9-tetrahydro-1-methyl-;2,3,4,9-Tetrahydro-1-methyl-1H-pyrido[3,4-b]indole-3-carboxylic acid;1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid;Tetrahydroharman-3-carboxylic acid;NSC 26225;1,2,3,4-Tetrahydro-3-carboxyharmane;1-Methyl-1,2,3,4-Tetrahydropyrido[3,4-b]indole-3-carboxylic acid;1,2,3,4-Tetrahydroharman-3-carboxylic acid;1-Methyl-2,3,4,9-tetrahydro-1H-β-carboline-3-carboxylic acid;1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid;1-Methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylic acid;22677-22-1
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CAS No:
Description
Solid
Solid
(1xi,3xi)-1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid is a harmala alkaloid.
1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid Basic Attributes
230.26200
230.26
298854|298851|26225
Characteristics
65.12000
2.15660
Solid
1.301g/cm3
242-243 °C (decomp)
488ºC at 760mmHg
248.9ºC
1.697
-20ºC
1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid Use and Manufacturing
Reactant involved in synthesis of molecules for biological studies including:• ;Cytotoxicity and insecticidal activities of harmine derivatives1• ;Isoquinolines, β-carbolines, and 3-deazapurines via oxidative decarboxylation2• ;Cytotoxic evaluation of 1,3-di- and 1,3,9-trisubstituted β-carbolines3
Computed Properties
Molecular Weight:230.26
XLogP3:-0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:230.105527694
Monoisotopic Mass:230.105527694
Topological Polar Surface Area:65.1
Heavy Atom Count:17
Complexity:321
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-Methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid
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