2-Bromoquinoxaline - CAS 36856-91-4

Catalog:	BB023115
Product Name:	2-Bromoquinoxaline
CAS:	36856-91-4
Synonyms:	2-bromoquinoxaline

Technical Data

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Computed Properties

IUPAC Name:	2-bromoquinoxaline
Description:	2-Bromoquinoxaline (CAS# 36856-91-4) is a useful research chemical.
Molecular Weight:	209.04
Molecular Formula:	C8H5BrN2
Canonical SMILES:	C1=CC=C2C(=C1)N=CC(=N2)Br
InChI:	InChI=1S/C8H5BrN2/c9-8-5-10-6-3-1-2-4-7(6)11-8/h1-5H
InChI Key:	XVKLMYQMVPHUPN-UHFFFAOYSA-N
Boiling Point:	275.7 °C at 760 mmHg
Purity:	95 %
Density:	1.656 g/cm³
MDL:	MFCD07368206
LogP:	2.39230

Publication Number	Title	Priority Date
CN-112939829-A	Synthetic method of aryl trifluoromethyl thioether	20210304
CN-112239452-A	Electron transport type heteroanthracene derivative and organic electroluminescent device thereof	20201014
WO-2021151062-A1	Heterocyclic compounds and uses thereof	20200124
WO-2021144460-A1	Controlled release formulations	20200115
WO-2021105117-A1	Substituted aminoquinolones as dgkalpha inhibitors for immune activation	20191128

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Related Functional Groups

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501
Signal Word:	Danger

Complexity:	140
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	207.96361
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	207.96361
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3