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2-BROMOMELATONIN

2-BROMOMELATONIN structure

CAS No:
142959-59-9
Formula:
C13H15BrN2O2
Chemical Name:
2-BROMOMELATONIN
Synonyms:
N-[2-(2-BROMO-5-METHOXY-1H-INDOL-3-YL)ETHYL]ACETAMIDE;2-BROMOMELATONIN;N-[2-(2-bromo-5-methoxy-1H-indol-3-yl)ethyl]ethanamide;N-Acetyl-2-broMo-5-MethoxytryptaMine;NSC 674637
Categories:
Organic Chemistry > Amides

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Description

Yellow Solid

2-BROMOMELATONIN Basic Attributes

Molecular Weight：

311.17

Exact Mass：

310.031677

NSC Number：

674637

DSSTox ID：

DTXSID60162239

HScode：

2933990090

Characteristics

PSA：

54.1

XLogP3：

2.03

Density：

1.5±0.1 g/cm3

Melting Point：

138-140°C

Boiling Point：

556.8±50.0 °C at 760 mmHg

Flash Point：

290.5±30.1 °C

Refractive Index：

1.622

Storage Conditions：

-20°C Freezer

Safety Information

Hazard category：

IRRITANT

Drug Information

MeSH Entry Terms：

2-bromomelatonin

2-BROMOMELATONIN Use and Manufacturing

A melatonin agonist with high affinity for chicken brain membrane melatonin receptors (Ki=0.031nM) in a comptetition radioligand binding assay using 2-[125I]iodomelatonin

Computed Properties

Molecular Weight:311.17
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:310.03169
Monoisotopic Mass:310.03169
Topological Polar Surface Area:54.1
Heavy Atom Count:18
Complexity:301
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes