2-Chloro-3-phenylpyrazine - CAS 41270-65-9

Catalog:	BB024843
Product Name:	2-Chloro-3-phenylpyrazine
CAS:	41270-65-9
Synonyms:	2-chloro-3-phenylpyrazine; 2-chloro-3-phenylpyrazine

Technical Data

Patents

Computed Properties

IUPAC Name:	2-chloro-3-phenylpyrazine
Description:	2-Chloro-3-phenylpyrazine (CAS# 41270-65-9) is a useful research chemical compound.
Molecular Weight:	190.63
Molecular Formula:	C10H7ClN2
Canonical SMILES:	C1=CC=C(C=C1)C2=NC=CN=C2Cl
InChI:	InChI=1S/C10H7ClN2/c11-10-9(12-6-7-13-10)8-4-2-1-3-5-8/h1-7H
InChI Key:	CAPLTXKTKMPKED-UHFFFAOYSA-N
Boiling Point:	280.5 °C at 760 mmHg
Density:	1.245 g/cm³
LogP:	2.79700

Publication Number	Title	Priority Date
WO-2021123174-A1	Sigma-1 receptor ligands and therapeutic uses thereof	20191219
CN-107833974-A	A kind of novel electroluminescent device	20170712
US-10615349-B2	Donor-acceptor type thermally activated delayed fluorescent materials based on imidazo[1,2-F]phenanthridine and analogues	20170519
US-2020227656-A1	Donor-acceptor type thermally activated delayed fluorescent materials based on imidazo[1,2-f]phenanthridine and analogues	20170519
AU-2015315693-A1	P2X7 modulating n-acyl-triazolopyrazines	20140912

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Complexity:	157
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.0297759
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	190.0297759
Rotatable Bond Count:	1
Topological Polar Surface Area:	25.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4